PhytoHub: Showing entry for Prunasin

Prunasin

Identification

PhytoHub ID

PHUB001458

Name

Prunasin

Systematic Name

Not Available

Synonyms

(R)-mandelonitrile beta-D-glucopyranoside
prulaurasin

CAS Number

138-53-4

Average Mass

295.291

Monoisotopic Mass

295.105587271

Chemical Formula

C₁₄H₁₇NO₆

IUPAC Name

2-phenyl-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}acetonitrile

InChI Key

ZKSZEJFBGODIJW-MXNNCRBYSA-N

InChI Identifier

InChI=1S/C14H17NO6/c15-6-9(8-4-2-1-3-5-8)20-14-13(19)12(18)11(17)10(7-16)21-14/h1-5,9-14,16-19H,7H2/t9?,10-,11-,12+,13-,14-/m1/s1

SMILES

OC[C@H]1O[C@@H](OC(C#N)C2=CC=CC=C2)[C@H](O)[C@@H](O)[C@@H]1O

Structure

Similar Structures

Calculated Properties

Solubility (ALOGPS): 2.82e+01 g/l
LogS (ALOGPS): -1.02
LogP (ALOGPS): -0.56
Hydrogen Acceptors: 7
Hydrogen Donors: 4
Rotatable Bond Count: 4
Polar Surface Area: 123.17
Refractivity: 70.0964
Polarizability: 29.085180853273357
Formal Charge: 0
Physiological Charge: 0
pKa (strongest basic): -2.981084265018608
pKa (strongest acidic): 12.207108673947591
Number of Rings: 2
Rule of Five: Yes
Bioavailability: Yes
Ghose Filter: No
Veber's Rule: No
MDDR-like Rule: No

External Links

ChEBI: CHEBI:25150
FooDB (Foods): FDB013526
HMDB: 34934

Taxonomy as Food Phytochemical

Family: N-containing compounds
Class: Miscellaneous N-containing compounds
Sub-class: Not Available

Spectra from Phytohub

Spectrum Type	Instrument Type	Ion Mode	Collision Energy Level	View	Peaks

LC-MS/MS	LC-ESI-QFT	Negative	medium	View Spectrum	(51.754694,0.00012113);(52.026977,0.00009719);(52.669118,0.00012442);(54.702342,0.000123);(55.017475,0.04656308);(55.193802,0.00015616);(55.291161,0.00013041);(55.314107,0.00014018);(55.893328,0.00008591);(56.020967,0.00012753);(56.513836,0.00010334);(56.95551,0.00012984);(57.033142,0.03382615);(57.088426,0.0000899);(57.241994,0.00012384);(57.75224,0.00010116);(58.004633,0.00077099);(58.036572,0.00025708);(58.189047,0.00011987);(58.342068,0.00014074);(58.664668,0.00013432);(58.778808,0.00011577);(59.012401,0.1812871);(59.120704,0.00014717);(59.479821,0.0001124);(59.60264,0.00011786);(60.01579,0.00285723);(60.081478,0.00011921);(60.091926,0.00010541);(61.257699,0.00015491);(61.659389,0.00011511);(61.906231,0.00014804);(61.986922,0.04100114);(62.898541,0.00011591);(62.952228,0.0001369);(63.536669,0.00009454);(64.625504,0.00015326);(64.790158,0.00013826);(65.129178,0.0001067);(65.164753,0.00010548);(65.591906,0.00015081);(66.128161,0.00011094);(67.017596,0.00011126);(67.664278,0.00013212);(68.012737,0.01076271);(68.364804,0.00011766);(68.849601,0.0001272);(68.996773,0.0020563);(69.033135,0.0076029);(70.732565,0.0001102);(70.770166,0.00010176);(71.012401,1.0);(71.052406,0.00012876);(71.722395,0.00013639);(72.01575,0.03170466);(72.433214,0.00012223);(72.755763,0.00012474);(72.991656,0.01290925);(73.012727,0.0001389);(73.028034,0.35155832);(74.031421,0.0103596);(75.007307,0.01987215);(75.25187,0.00013047);(77.112889,0.00010368);(78.523963,0.00013803);(78.966864,0.00023375);(78.984476,0.0062866);(79.877424,0.00012396);(79.955927,0.02071181);(80.642227,0.00009108);(80.797359,0.00014159);(80.963775,0.01993882);(81.033153,0.00448325);(81.495442,0.00014282);(81.559008,0.00013387);(81.951621,0.00020817);(82.71205,0.00014057);(82.95045,0.00012975);(82.959588,0.00011713);(83.012403,0.09550088);(84.015795,0.00232121);(84.020072,0.00012278);(84.582162,0.00013526);(85.028083,0.39065545);(85.07146,0.00014144);(85.221315,0.00011051);(86.031432,0.01590763);(86.537375,0.0001426);(87.007327,0.02390887);(88.010624,0.00017368);(88.863173,0.00012851);(89.022994,0.02749445);(89.939693,0.00013545);(90.225662,0.00009632);(90.394694,0.00015923);(90.57447,0.00014966);(91.694539,0.00008929);(92.92662,0.07269701);(93.350593,0.00008876);(94.923693,0.05349448);(94.979463,0.01636441);(95.012448,0.09073068);(95.951076,0.00025718);(96.015866,0.00352558);(96.171183,0.00013808);(96.512195,0.0001337);(96.920666,0.00281086);(96.958719,0.16345274);(97.02811,0.02152736);(97.369587,0.00012128);(97.958163,0.00032897);(98.95456,0.00480073);(98.963121,0.00024439);(99.007369,0.11389906);(99.043787,0.00032776);(99.547842,0.000125);(100.010805,0.00290579);(100.015153,0.00123324);(100.729928,0.00015878);(100.825719,0.00015468);(100.960875,0.00018953);(101.023033,0.50206449);(101.818733,0.00013923);(102.02639,0.02013511);(104.226362,0.00010123);(108.059244,0.00013819);(109.32105,0.00011814);(109.843127,0.0001492);(109.954468,0.00013406);(110.023206,0.00034416);(110.873272,0.0001635);(110.956371,0.00019345);(112.490918,0.00013764);(112.935857,0.00236134);(113.023066,0.5272388);(114.026417,0.02734485);(115.038852,0.00075392);(115.717388,0.00011212);(116.578162,0.00013189);(116.971405,0.00017893);(117.093576,0.00014561);(119.048934,0.00679174);(119.945649,0.1072809);(120.525455,0.00010337);(120.995194,0.00026466);(121.028156,0.00204437);(121.942676,0.0138285);(124.614158,0.00010829);(124.925188,0.00011167);(124.972415,0.00030516);(125.023074,0.02327469);(125.943817,0.0004044);(129.017999,0.01506103);(129.054253,0.0004101);(131.036411,0.06567142);(131.048828,0.00179888);(131.69634,0.00014039);(132.039691,0.00326232);(133.064463,0.00344095);(134.609334,0.00014144);(135.043893,0.00637824);(136.476149,0.00009493);(137.739766,0.0001175);(137.914418,0.00010499);(137.96471,0.00014639);(138.758949,0.00016094);(140.63391,0.00010598);(140.840036,0.0001009);(141.554268,0.0001269);(143.033678,0.01765758);(144.037534,0.00013394);(145.028252,0.01093902);(147.044001,0.00540067);(147.637087,0.00009496);(149.001529,0.00012152);(150.567742,0.00015721);(150.885184,0.0001389);(152.882629,0.00121599);(152.938252,0.0036273);(154.935145,0.0001397);(156.908527,0.00028189);(159.02865,0.07185401);(159.043985,0.00220677);(160.032116,0.00301126);(161.001389,0.00036492);(161.044393,0.22897504);(161.059958,0.00533711);(162.04096,0.00014576);(162.047767,0.01481792);(163.038976,0.00574534);(163.866286,0.00014738);(164.834692,0.00014162);(165.933407,0.00014607);(169.474343,0.00013045);(171.931805,0.00022786);(174.429594,0.00012874);(175.038944,0.01591695);(176.042595,0.00033636);(176.899691,0.00806811);(177.904928,0.00012167);(177.957443,0.00012045);(178.050885,0.00008845);(178.08728,0.0001727);(178.313791,0.00015036);(178.354952,0.00011743);(178.896333,0.00054496);(179.064432,0.00011358);(182.884748,0.0001204);(185.153676,0.00012195);(189.055033,0.00091778);(191.539956,0.00009242);(192.028974,0.00026077);(192.114458,0.00128011);(192.272694,0.00012995);(193.158829,0.00433322);(195.472359,0.00014733);(196.151688,0.00012975);(198.180437,0.00014041);(201.943182,0.00012557);(202.763232,0.00013521);(204.140047,0.00013114);(208.866821,0.00013289);(209.033832,0.00014594);(209.079024,0.00061467);(210.002312,0.00015219);(213.149001,0.000619);(213.185299,0.00136901);(214.145101,0.00016755);(214.661405,0.00011108);(215.728056,0.00326194);(215.738533,0.00496635);(216.358178,0.00015244);(216.370619,0.00012838);(220.1461,0.02381737);(221.154082,0.05283581);(221.341001,0.00016181);(221.693864,0.00013711);(222.157285,0.00762012);(222.403911,0.00014344);(224.074761,0.00013327);(225.006921,0.00009943);(225.277447,0.00013943);(227.257998,0.00014043);(231.003059,0.0001823);(232.924123,0.0004369);(233.057339,0.00014687);(233.9369,0.00017839);(234.858629,0.00076868);(234.92286,0.0024109);(234.934394,0.00012019);(235.245237,0.00015206);(236.105077,0.04312744);(236.855657,0.00030626);(237.108361,0.00536604);(238.986279,0.00259513);(240.332423,0.00011055);(240.556859,0.00013512);(242.016102,0.00012163);(242.863956,0.00156569);(245.159038,0.00014137);(246.584775,0.00022853);(249.186828,0.00055966);(250.315547,0.00014473);(257.887224,0.00363353);(259.88333,0.00036337);(262.448077,0.00012522);(266.963561,0.00070835);(274.880495,0.00967482);(275.853212,0.00061945);(275.880919,0.00091599);(275.897688,0.01169963);(276.877906,0.00030238);(276.89794,0.00067537);(277.216278,0.00013347);(277.878651,0.00049042);(277.894565,0.00271476);(278.462276,0.00013345);(282.642991,0.00013642);(293.178774,0.33414425);(293.864135,0.00081061);(293.899544,0.00018692);(294.136011,0.0141823);(294.182274,0.0532085);(294.201607,0.00013602);(294.958192,0.00016488);(294.994722,0.00957316);(295.137082,0.02103241);(295.157796,0.02121047);(295.174978,0.01101159);(295.227184,0.01187826);(295.263821,0.00745373);(295.860757,0.0004043);(295.994922,0.00041223);(296.14041,0.00058531);(296.160307,0.00057205)
LC-MS/MS	LC-ESI-QFT	Negative	high	View Spectrum	(50.017754,0.0001818);(50.221014,0.00027563);(50.965208,0.00015964);(51.205681,0.00027366);(51.547751,0.0001944);(51.904006,0.0002213);(52.238462,0.00018491);(52.432652,0.0002645);(52.503639,0.00023766);(52.823174,0.00027322);(53.624006,0.00017436);(53.62756,0.00024874);(53.749824,0.00018869);(55.017484,0.09131582);(55.114113,0.00023865);(56.21845,0.00020592);(56.390681,0.00029852);(56.602034,0.00018443);(56.731349,0.00023404);(57.033129,0.06841349);(57.075406,0.00027039);(57.381293,0.00020417);(57.907467,0.0002393);(57.934421,0.0001721);(58.004542,0.00033792);(58.03655,0.00023334);(58.405732,0.00018413);(58.691046,0.00020194);(58.6937,0.00022627);(59.012379,0.23952033);(60.015782,0.00306232);(60.319376,0.00022816);(61.986908,0.0827225);(62.72265,0.00019951);(63.191641,0.00029553);(63.312194,0.00017642);(63.406304,0.00022109);(63.961081,0.00111957);(64.100015,0.00020946);(65.566272,0.00029425);(65.598914,0.00034318);(65.636611,0.00027399);(66.25282,0.00023835);(67.15186,0.00026454);(68.012758,0.00975035);(68.259962,0.00021695);(68.99671,0.00138625);(69.033154,0.00810375);(71.000947,0.00349258);(71.012396,1.0);(71.022988,0.00434241);(71.082018,0.00022611);(72.015763,0.03048276);(72.991665,0.01639868);(73.001854,0.00023486);(73.016402,0.00038318);(73.028063,0.36809641);(73.039127,0.00021799);(73.546598,0.00027568);(74.031398,0.00906679);(74.34873,0.00025673);(75.007358,0.02490891);(75.067747,0.00018351);(75.239406,0.00025941);(75.57599,0.00033406);(77.274156,0.00022285);(77.739586,0.00025151);(77.988433,0.0002212);(78.512123,0.00032013);(78.984504,0.00883618);(79.501841,0.00019029);(79.953257,0.00050594);(79.955904,0.04382433);(80.119998,0.00034823);(80.963763,0.0254183);(81.033132,0.00155429);(82.416798,0.00023453);(83.012412,0.13086206);(83.02545,0.00024089);(83.458612,0.00026198);(84.01579,0.00382007);(84.020303,0.00061221);(84.677625,0.00029412);(85.012878,0.00165048);(85.028043,0.55223029);(85.042098,0.00079053);(86.031433,0.02323643);(87.007313,0.02611347);(88.093456,0.0002686);(89.022977,0.01337482);(89.559979,0.00029792);(91.108671,0.00024633);(91.319125,0.0002738);(92.491291,0.00026797);(92.655382,0.00026041);(92.926615,0.07724468);(93.292004,0.00020494);(94.923643,0.0579554);(94.979445,0.02146129);(95.007077,0.00026266);(95.012411,0.10595427);(95.223346,0.00025308);(96.015735,0.00178351);(96.746407,0.00024993);(96.920742,0.00261049);(96.940725,0.00078113);(96.958663,0.49962186);(96.975328,0.0003187);(97.028108,0.01458038);(97.958171,0.00152895);(98.954548,0.01680144);(98.962766,0.00061805);(99.007364,0.0918062);(99.901608,0.00022841);(100.010661,0.00138981);(100.014777,0.00025264);(100.749418,0.00023571);(101.023021,0.3699666);(101.041285,0.0002686);(102.026435,0.01427267);(104.736612,0.00028832);(107.271727,0.00024095);(107.301766,0.00024324);(111.271292,0.00029052);(112.248067,0.00026793);(112.935991,0.00113378);(113.023004,0.32946158);(113.439811,0.00036044);(114.026463,0.01551161);(114.925435,0.00023218);(115.592625,0.00019313);(117.158031,0.00028489);(117.631194,0.00028889);(117.872161,0.0002507);(118.939911,0.000193);(119.049075,0.00993786);(119.945594,0.07775755);(120.655581,0.00029414);(121.028141,0.000988);(121.798128,0.0002823);(121.942684,0.01035784);(123.23884,0.00023748);(124.854214,0.00029174);(125.023136,0.00828004);(125.943388,0.00026237);(129.017936,0.00316925);(131.036393,0.05357319);(131.049014,0.00231964);(132.039719,0.00185077);(133.064671,0.00283434);(133.269926,0.00028011);(135.043847,0.00400013);(139.002281,0.00027027);(140.844388,0.00018209);(143.033961,0.00068061);(143.657837,0.00027659);(145.028325,0.01158542);(146.942533,0.00024723);(147.043928,0.00164111);(147.115003,0.00034071);(150.054674,0.00027633);(152.938271,0.00031266);(155.515842,0.00036236);(158.993701,0.00029268);(159.028676,0.0207282);(159.043611,0.00031601);(159.249794,0.00027126);(160.575404,0.00020925);(161.001202,0.0002396);(161.022814,0.0003255);(161.044317,0.041321);(162.047805,0.00038951);(163.65766,0.00033397);(166.240202,0.00030969);(167.552809,0.00021244);(168.069626,0.0003437);(168.701003,0.00026299);(173.312923,0.00031995);(175.039157,0.00770771);(175.288667,0.00021575);(175.899493,0.00023743);(176.89943,0.00605452);(178.390677,0.00029177);(178.896614,0.00049164);(180.776863,0.00023706);(185.02782,0.00025482);(185.511949,0.00026297);(189.793545,0.00020924);(190.060475,0.00024956);(192.029284,0.00060202);(192.114571,0.00333458);(193.15893,0.00203165);(203.231612,0.00017222);(205.122001,0.00026082);(206.173202,0.00021761);(209.946488,0.00022729);(211.902063,0.00022927);(213.184768,0.00045475);(215.726131,0.0117206);(218.094293,0.00028105);(218.558585,0.00020668);(220.146153,0.03373624);(221.154047,0.05951072);(222.157537,0.00798144);(228.634668,0.00023604);(230.955169,0.00022159);(234.450488,0.00018316);(234.943028,0.00021243);(236.105245,0.02081452);(237.108623,0.00083818);(238.986238,0.00026776);(240.443625,0.00023008);(242.863678,0.00822112);(243.11379,0.0002476);(244.860724,0.00093058);(246.684942,0.00028218);(246.826834,0.00022963);(251.366911,0.00026222);(257.886953,0.00340356);(260.385529,0.00022516);(262.174839,0.00026252);(266.13921,0.0003094);(266.962943,0.00042777);(269.763339,0.0002852);(270.688774,0.0002335);(272.203361,0.00032349);(274.880754,0.00893295);(275.880696,0.00062331);(275.897714,0.00462991);(276.897407,0.00018883);(277.893774,0.00107574);(280.769117,0.00021209);(287.112947,0.00031266);(288.842727,0.0002495);(290.529891,0.00031783);(293.179066,0.14499412);(294.136042,0.0032811);(294.182408,0.02356824);(294.994524,0.00255145);(295.137206,0.01543539);(295.157492,0.00967685);(295.174186,0.00198737);(295.226402,0.00034894);(295.263362,0.00058613);(296.141038,0.00019857)
LC-MS/MS	LC-ESI-QFT	Negative	high	View Spectrum	(50.570884,0.00028283);(51.238224,0.00037246);(51.477364,0.00036202);(51.484816,0.00038599);(51.953296,0.00028504);(53.001884,0.00029973);(53.932478,0.00035598);(54.152369,0.00048062);(54.790641,0.00036869);(55.017487,0.20148603);(55.025284,0.00036748);(55.029373,0.00040925);(55.130386,0.00025249);(55.295138,0.00027341);(55.657845,0.00033473);(55.975698,0.00027404);(55.98005,0.00030075);(56.020841,0.00232911);(56.195847,0.00025449);(56.56937,0.00029246);(57.033145,0.14237896);(57.724783,0.00037257);(58.00463,0.00374906);(58.018764,0.0004002);(58.036559,0.00114158);(58.674625,0.00031073);(59.012392,0.32042736);(59.163567,0.0004016);(59.285565,0.00036219);(59.323447,0.00041834);(59.839315,0.00028753);(60.015726,0.00270034);(60.050768,0.00036032);(60.063831,0.00023849);(60.402176,0.00029319);(60.409979,0.00037989);(60.660316,0.00024651);(61.024107,0.00036376);(61.986926,0.20669474);(61.996178,0.00072608);(62.018655,0.00033067);(62.115856,0.00034485);(62.87302,0.00023508);(63.255648,0.00030472);(63.891563,0.00031348);(63.961024,0.01232331);(64.230007,0.00030543);(65.411487,0.00037037);(65.666979,0.00033984);(66.424818,0.00032433);(66.874784,0.0004395);(67.017537,0.00242093);(67.439952,0.00032072);(68.012752,0.01196666);(68.414625,0.00042025);(68.542477,0.00040213);(68.845251,0.00032646);(68.99678,0.00396597);(69.033161,0.01094346);(69.337788,0.00040394);(70.222106,0.0004506);(71.000048,0.00040147);(71.002031,0.00078091);(71.012401,0.85265118);(71.023692,0.0019759);(71.333245,0.00040417);(71.662022,0.00029748);(71.717301,0.00035503);(72.015753,0.02340903);(72.187526,0.00037411);(72.944176,0.00219284);(72.991615,0.02736321);(73.028052,0.25463763);(73.037138,0.00030756);(73.328378,0.00037377);(74.031429,0.0034582);(74.480021,0.00037388);(74.672684,0.00031021);(74.675315,0.00030637);(74.719097,0.00035613);(75.007319,0.01634453);(75.22801,0.00037895);(75.609819,0.00026671);(76.488829,0.00034796);(76.677983,0.00043565);(78.278855,0.0002952);(78.984484,0.01238514);(79.955913,0.13471085);(80.023846,0.00024426);(80.963749,0.03266604);(81.498612,0.00033338);(81.787346,0.00050016);(81.951722,0.00316413);(82.244715,0.00032777);(82.353756,0.0002847);(82.599506,0.00029092);(83.012404,0.11056626);(83.03885,0.00036922);(83.260404,0.00033783);(83.48681,0.00038614);(83.740364,0.00038509);(83.989581,0.00037674);(84.015804,0.00134383);(84.020296,0.01859524);(85.028057,0.46723888);(85.043068,0.00049316);(85.180143,0.0002502);(85.789958,0.00041988);(86.031406,0.01527158);(86.87606,0.00036059);(87.007376,0.0326137);(87.267817,0.00030912);(87.550143,0.00039619);(87.866638,0.00034914);(88.400561,0.00030684);(88.606615,0.00034244);(89.023039,0.00113721);(89.174374,0.00023416);(89.570788,0.00037785);(90.950577,0.00038078);(92.269398,0.00042991);(92.926635,0.0804973);(93.010453,0.00043146);(94.408847,0.0002943);(94.923695,0.05887723);(94.979461,0.04078961);(95.012426,0.06970886);(95.95091,0.01382097);(96.70187,0.00039866);(96.773057,0.00040861);(96.920742,0.00211969);(96.941948,0.00086935);(96.958698,1.0);(96.976823,0.00429867);(97.02813,0.00648229);(97.958144,0.0046343);(97.962618,0.00026522);(98.954511,0.03740098);(98.962924,0.00334124);(99.007409,0.04318637);(99.203752,0.00028577);(99.339156,0.00037853);(100.010637,0.00050461);(100.051095,0.00091461);(100.444041,0.00040935);(100.585653,0.00031188);(101.023044,0.12905006);(101.038153,0.00068424);(101.924577,0.00039842);(102.026272,0.00126909);(105.481812,0.00033365);(107.370231,0.0003211);(109.616763,0.00038412);(111.539995,0.00044034);(111.840568,0.00035948);(112.534107,0.00043073);(112.936055,0.0009491);(113.023081,0.06453801);(113.090362,0.00032628);(114.026431,0.00043818);(117.033261,0.0079969);(118.693405,0.00036525);(118.836495,0.00034857);(118.979598,0.00089966);(119.048943,0.01342542);(119.589611,0.00036484);(119.945708,0.02373422);(119.977789,0.00046286);(120.351138,0.00035973);(120.403653,0.00038269);(120.91877,0.00027889);(121.028214,0.00083886);(121.684524,0.00037654);(121.871642,0.00043371);(121.91061,0.00047736);(121.942914,0.00247033);(121.990162,0.00034865);(123.347773,0.00044489);(125.022934,0.00031527);(125.620449,0.00040711);(126.188989,0.00037576);(129.291603,0.00035763);(131.036386,0.01394209);(131.049793,0.00054485);(133.065024,0.00080831);(135.097526,0.00032076);(135.818322,0.000336);(136.087888,0.00033552);(139.599285,0.00041042);(141.090789,0.00087551);(142.019507,0.00030416);(142.057997,0.00036683);(143.555728,0.00030306);(143.663496,0.0004121);(145.028328,0.01020178);(146.427258,0.0002589);(147.043978,0.00039574);(148.05203,0.00143727);(154.11447,0.00042254);(157.867476,0.00034956);(158.743297,0.0003946);(159.956822,0.00032173);(163.237709,0.00032514);(164.083532,0.00033672);(165.423584,0.00050674);(168.595468,0.00047049);(170.46742,0.00042345);(172.523374,0.00032735);(174.067553,0.00026288);(174.294476,0.00029899);(174.653561,0.00030303);(177.091088,0.01199695);(179.176276,0.00033546);(186.429567,0.00047265);(192.11464,0.00565498);(195.478964,0.00027513);(201.572697,0.00041885);(204.658082,0.00039684);(205.122661,0.02298468);(206.125915,0.00045943);(209.027474,0.00028952);(210.955512,0.00041833);(212.631343,0.00034087);(212.865814,0.0003484);(214.913048,0.00059529);(215.192244,0.00038256);(216.295233,0.00046451);(220.146209,0.04685368);(220.281098,0.00539541);(220.304922,0.00115694);(220.976185,0.00169402);(221.154166,0.05505513);(222.157366,0.00466678);(227.797674,0.00026696);(236.456213,0.0002856);(238.735074,0.00037934);(240.88502,0.00069533);(242.863682,0.01796143);(244.842953,0.00470797);(244.860845,0.00420451);(245.168824,0.00053048);(247.268587,0.00043655);(247.88998,0.00043965);(251.074176,0.00033806);(259.725481,0.00043299);(261.877875,0.00030181);(265.090921,0.00028015);(274.545262,0.00034752);(274.880674,0.01551936);(282.977414,0.00037854);(288.663513,0.00053266);(288.715924,0.00033735);(293.178925,0.00216629);(294.061471,0.00034491);(295.1376,0.00506172)
LC-MS/MS	LC-ESI-QFT	Positive	medium	View Spectrum	(55.01854,0.0046666);(55.054952,0.0216996);(56.05017,0.00311994);(57.034197,0.05040525);(57.070585,0.06357546);(58.065835,0.02524997);(59.049843,0.073445);(59.99092,0.00080672);(61.011315,0.03210589);(61.029086,0.01084577);(62.019149,0.00718979);(62.9824,0.04821815);(67.054862,0.05291729);(68.050085,0.00083868);(69.034114,0.04776643);(69.070497,0.05525319);(70.065739,0.01926092);(71.049754,0.02530717);(71.086117,0.04087325);(71.982664,0.00227061);(72.044981,0.0069775);(72.0813,0.0047212);(73.029016,0.07194739);(73.047395,0.00608504);(73.065351,0.00614876);(74.060665,0.00109531);(74.096938,0.00444523);(75.044591,0.00240659);(77.0602,0.00319188);(79.021759,0.01944559);(79.054732,0.02158766);(80.948359,0.04731545);(81.019049,0.03718096);(81.033996,0.01114972);(81.070383,0.08368119);(82.065723,0.00241919);(82.073759,0.00202096);(82.945393,0.01748816);(83.022068,0.00287061);(83.049604,0.01753464);(83.086012,0.04824441);(84.044852,0.00249644);(84.081202,0.00867299);(85.028889,0.07571035);(85.065233,0.02346399);(85.101685,0.02120067);(86.032152,0.00097193);(86.06048,0.01604872);(86.096861,0.02539957);(87.044479,0.19383782);(88.047859,0.00337974);(88.076085,0.00452671);(89.060112,0.24356053);(90.06342,0.00282247);(91.054606,0.01907549);(91.057753,0.04997235);(92.974839,0.00689314);(92.982924,0.00155736);(93.070236,0.0496554);(94.026718,0.01533893);(94.07376,0.00097849);(95.049442,0.01416641);(95.08589,0.1474874);(96.044684,0.00111962);(96.089164,0.00663044);(96.922138,0.03619578);(97.028726,0.07503038);(97.065086,0.02308543);(97.101496,0.03094785);(98.060339,0.00761958);(98.919111,0.00201346);(98.984303,0.0007691);(99.04437,0.02024588);(99.080766,0.01825765);(100.039598,0.01109785);(100.075965,0.03112097);(100.112397,0.00172585);(101.003475,0.03143032);(101.060033,0.0161077);(102.055217,0.00165446);(103.039247,0.2493817);(103.07559,0.02915553);(104.042566,0.0034881);(104.982925,0.00135716);(104.99256,0.00474389);(105.033646,0.01448694);(105.070075,0.01478268);(106.065285,0.01171019);(106.998551,0.00342325);(107.008158,0.00401846);(107.049331,0.01125094);(107.070452,0.00984876);(107.085746,0.05101766);(107.966895,0.00296843);(108.016645,0.00285107);(108.04211,0.00183518);(108.088939,0.00088981);(108.977917,0.00104258);(109.028579,0.01116827);(109.06492,0.01205757);(109.101332,0.06567395);(110.060327,0.00322889);(110.104783,0.00151959);(110.939384,0.00256858);(111.044259,0.00491668);(111.080652,0.01653199);(111.11695,0.00600006);(112.075844,0.00848754);(113.059861,0.00920589);(113.096229,0.02396484);(114.054928,0.00168013);(114.09152,0.00491302);(115.039119,0.05068376);(115.075432,0.00112219);(115.086719,0.00341335);(116.052939,0.01623978);(116.07071,0.00672758);(117.069948,0.00393513);(117.091022,0.00110745);(118.065201,0.02782155);(118.97177,0.00393141);(119.049176,0.00899809);(119.085525,0.02319276);(120.080801,0.00297944);(120.987303,0.00413925);(121.023526,0.00195382);(121.028457,0.00152139);(121.064829,0.01291643);(121.101259,0.04976564);(122.939084,0.01527417);(123.041991,0.00102474);(123.044089,0.00084537);(123.080411,0.01716057);(123.116815,0.03159541);(124.075616,0.00131358);(124.936982,0.00080361);(124.964409,0.03068623);(125.059784,0.00187861);(125.09606,0.01329234);(125.935649,0.00477275);(126.054855,0.00379462);(126.091309,0.19532819);(127.038976,0.02169506);(127.075384,0.00106749);(127.094608,0.0139074);(127.111679,0.0030863);(128.106877,0.0052271);(129.012873,0.00398547);(129.052341,0.00228124);(129.940689,0.00144127);(130.158932,0.00772073);(130.506253,0.01054773);(131.0078,0.00085093);(131.070235,0.05419338);(131.085445,0.01126045);(132.080674,0.00112105);(132.987113,0.00487272);(133.049384,0.00571052);(133.064597,0.01197508);(133.085806,0.06597558);(133.101073,0.02284105);(133.982414,0.00182378);(134.059885,0.02312216);(134.978518,0.00286216);(134.99675,0.00083643);(135.002809,0.01383182);(135.080226,0.00946095);(135.116688,0.04116588);(136.061491,0.00105646);(136.075618,0.05307341);(137.059423,0.00430988);(137.09586,0.01367001);(137.132357,0.01233276);(138.017992,0.05023718);(138.09103,0.0022278);(138.127713,0.00148912);(138.518456,0.00170091);(138.964718,0.0084225);(139.049981,0.00696888);(139.074906,0.00349916);(139.111561,0.01305614);(140.070176,0.00160166);(140.959077,0.00921006);(141.12715,0.00793142);(142.122376,0.00100865);(142.938409,0.00188447);(144.06542,0.00468656);(145.049312,0.01155456);(145.100891,0.01094555);(146.059366,0.00111281);(147.043888,0.00173817);(147.064903,0.00713391);(147.080314,0.00136206);(147.116616,0.02017664);(148.925381,0.0013275);(149.095726,0.00886894);(149.13233,0.018962);(150.077515,0.00119908);(150.089354,0.00303476);(151.07499,0.00341177);(151.09623,0.00260255);(151.111555,0.01296412);(151.148002,0.00105076);(152.070506,0.00199201);(152.951121,0.00082595);(152.96755,0.00799928);(152.989138,0.01428157);(153.090796,0.00448265);(153.127254,0.00830762);(153.958992,0.0015562);(154.085784,0.00081506);(154.12282,0.00079143);(154.158268,0.00083773);(154.946914,0.00356754);(154.977682,0.03102856);(154.984214,0.00318578);(155.106466,0.00879287);(155.954481,0.01360261);(155.978589,0.0035957);(156.936355,0.00164946);(156.954339,0.00143966);(156.974818,0.18065678);(157.101072,0.00208198);(157.951863,0.00074355);(157.966831,0.00209883);(157.975455,0.01421103);(158.059836,0.00774547);(158.971771,0.01896258);(159.04738,0.00201119);(159.116588,0.00850984);(160.075366,0.00156794);(161.096257,0.00282289);(161.132258,0.01469424);(163.038703,0.09730512);(163.075393,0.00075419);(163.096282,0.00584773);(163.111447,0.00473811);(163.147937,0.01099194);(164.042244,0.0020496);(164.104925,0.00382508);(164.920571,0.00117404);(165.049537,0.00685983);(165.054135,0.00571886);(165.090536,0.00224009);(165.11148,0.00116678);(165.127276,0.00377536);(166.08601,0.01584998);(167.117421,0.00268756);(168.101642,0.00549078);(168.982647,0.00526372);(170.117311,0.97754037);(170.951772,0.00623863);(170.978085,0.02860177);(170.990273,0.00686376);(171.120814,0.09422872);(172.114799,0.00130761);(172.123079,0.00190802);(172.957459,0.00465373);(172.975466,0.00247883);(172.988245,0.06027169);(173.132241,0.00630887);(173.989253,0.01177698);(174.956058,0.00151595);(174.971962,0.00491558);(174.985341,0.32421126);(175.039129,0.0007334);(175.075233,0.00101273);(175.096286,0.01703215);(175.147966,0.00708938);(175.977145,0.00677377);(175.985943,0.03042605);(176.98229,0.03247238);(177.057468,0.01304678);(177.09026,0.00094752);(177.111758,0.00697646);(177.127103,0.00408494);(177.163507,0.00182316);(178.086065,0.00379756);(178.120208,0.00453209);(179.106026,0.00182172);(179.142754,0.00284769);(179.969702,0.00108773);(180.894388,0.00509463);(180.951746,0.00110152);(181.084342,0.00087339);(181.097177,0.00239535);(182.080681,0.00526748);(184.948927,0.04058166);(184.994005,0.00082193);(187.038834,0.00093158);(187.147757,0.00207072);(187.944455,0.00355377);(188.021058,0.00074173);(189.000867,0.01895384);(189.126607,0.00107544);(189.975061,0.00205866);(192.053944,0.00082906);(192.135604,0.00162486);(192.965885,0.00137925);(193.044356,0.0041488);(193.131339,0.00662561);(193.158059,0.00167739);(194.115099,0.01957395);(195.060167,0.02830105);(195.12258,0.00090475);(197.890192,0.00116245);(201.130044,0.00091533);(201.163079,0.00140059);(204.961593,0.00441309);(205.085252,0.00092028);(205.990636,0.00080391);(206.115737,0.00237098);(206.152264,0.00271607);(206.977505,0.03768442);(207.099071,0.00467391);(207.674636,0.00543934);(207.985412,0.05045939);(209.043641,0.00072951);(209.076072,0.00778512);(213.01061,0.00082558);(214.085899,0.00179474);(214.981149,0.01747465);(215.127643,0.00240265);(215.680709,0.01153903);(215.694138,0.00659424);(215.981992,0.00121565);(216.679486,0.00127542);(216.92949,0.00544594);(216.977856,0.22676384);(217.97876,0.02893632);(218.151276,0.04649909);(218.974466,0.03943675);(219.137627,0.00076137);(219.154654,0.00358426);(219.173905,0.02197438);(219.665938,0.00970334);(220.167161,0.00422737);(220.177675,0.02562246);(221.115554,0.00176524);(221.162491,0.0241944);(221.180623,0.04235584);(222.18352,0.00281717);(222.898329,0.03717888);(223.094324,0.00144791);(225.042599,0.03809233);(226.042882,0.00102479);(227.021614,0.00171624);(228.671225,0.04646529);(229.104599,0.01140043);(229.172532,0.00905531);(232.944833,0.00107907);(232.991317,0.02244348);(233.992451,0.00335907);(234.148184,0.0016815);(234.940549,0.01184922);(234.96,0.01196195);(234.98833,0.26941572);(235.06019,0.00333577);(235.105354,0.00206979);(235.67892,0.00117647);(235.989193,0.03737939);(236.136813,0.03452504);(236.162776,0.00439173);(236.20065,0.00303087);(236.914015,0.00335886);(236.936717,0.00081248);(236.984745,0.05535552);(237.02574,0.0014219);(237.109235,0.02629565);(237.12091,0.02498344);(237.142435,0.0009704);(237.676248,0.04433786);(238.177904,0.01318226);(238.21625,0.00234644);(238.8935,0.00328141);(238.967392,0.00280217);(239.026021,0.00074191);(239.088231,0.00570499);(239.236813,0.00194415);(239.901091,0.00710274);(240.908915,0.08437196);(241.194152,0.00099522);(241.910459,0.00223545);(243.210459,0.00139646);(244.684142,0.00303299);(248.161722,0.02390127);(248.200042,0.00121025);(249.004008,0.01319567);(249.165034,0.00636943);(249.220734,0.0017923);(250.178565,0.0032182);(251.003402,0.00160226);(252.950209,0.00871594);(252.969418,0.00316241);(253.102051,0.00415259);(254.92426,0.01408549);(257.099124,0.01063743);(261.220573,0.00750751);(262.178296,0.00256489);(263.104321,0.00242637);(263.124717,0.00428799);(263.900837,0.02098265);(264.156804,0.04703545);(264.192845,0.03540728);(264.908176,0.00481774);(265.019132,0.03282374);(265.140393,0.01219292);(265.158853,0.00308049);(265.195974,0.00411284);(266.136124,0.00113244);(266.172386,0.03053533);(266.247688,0.0051285);(266.998694,0.05321604);(267.035176,0.00607532);(267.998877,0.00391228);(268.978525,0.00227807);(269.014382,0.01183392);(276.231681,0.00199398);(277.215864,0.01279438);(278.137873,0.00113414);(278.17406,0.00380481);(278.210547,0.00166682);(279.156364,0.00098591);(279.206612,0.00226109);(279.230935,0.00732017);(280.190301,0.00101833);(280.262991,0.00251385);(281.014111,0.03905946);(281.050581,0.05876268);(281.911491,0.1859829);(282.014756,0.00350498);(282.051403,0.00661062);(282.137034,0.00371215);(282.915008,0.01566275);(283.029944,1.0);(284.030099,0.15642411);(284.152773,0.01790239);(285.009214,0.01752508);(285.045568,0.16259589);(285.814975,0.00792617);(286.045885,0.02382951);(286.823162,0.00370438);(287.830656,0.00514182);(294.083159,0.0040422);(294.169051,0.00665632);(294.203462,0.02041574);(294.222087,0.00092358);(294.240659,0.04621773);(294.278712,0.00976003);(294.314937,0.00303231);(295.085339,0.00346455);(295.11261,0.01149676);(295.150648,0.07864051);(295.164251,0.0105705);(295.18629,0.00892749);(295.201458,0.01960912);(295.224023,0.00188407);(295.24258,0.01358117);(295.277137,0.00088024);(295.309576,0.00111099);(295.927178,0.00878188);(296.111476,0.01078979);(296.128508,0.0023953);(296.150098,0.01395434);(296.166911,0.0058458);(296.183363,0.02099703);(296.201563,0.00338639);(296.220134,0.01812765);(296.237295,0.0140751);(296.257678,0.01807961);(296.294416,0.45596614);(296.329953,0.02258664);(296.926067,0.00314915);(297.045734,0.63748294);(297.091509,0.73463746);(297.129807,0.04198082);(297.166618,0.06787371);(297.181227,0.00692156);(297.201386,0.00512817);(297.219715,0.00898901);(297.239433,0.05412117);(297.258093,0.00595407);(297.278225,0.03127422);(297.297432,0.0899781);(297.331773,0.00112642);(298.046038,0.11022541);(298.094871,0.05156167);(298.124624,0.02873196);(298.164122,0.0037058);(298.199221,0.0079585);(298.217268,0.00274479);(298.237679,0.00115721);(298.253243,0.01163704);(298.273032,0.00857702);(298.310069,0.01194201);(298.346265,0.08755213);(299.061166,0.8800854);(300.061417,0.13641369);(300.147242,0.00172038);(301.040643,0.03343654)
LC-MS/MS	LC-ESI-QFT	Positive	high	View Spectrum	(51.913095,0.00047621);(52.432339,0.00062058);(52.652449,0.00047834);(53.002932,0.0006268);(53.039298,0.00113643);(53.180283,0.00049837);(53.442121,0.00050729);(53.842905,0.00054988);(55.018567,0.01391398);(55.054955,0.04741234);(55.53984,0.00050139);(55.568553,0.00049286);(55.908728,0.00048064);(56.050196,0.00645291);(56.058351,0.0006204);(56.965455,0.00438761);(57.034195,0.04395263);(57.070584,0.10370634);(57.922427,0.00047936);(58.065805,0.03038545);(58.073917,0.00140451);(59.049832,0.06174039);(59.99088,0.00054817);(60.045097,0.0005236);(60.053112,0.00064356);(61.011319,0.03094068);(61.029061,0.00851645);(61.597469,0.00056021);(62.019137,0.00781658);(62.9824,0.06410586);(62.990639,0.00198223);(62.997114,0.00054368);(63.026937,0.00127195);(63.244768,0.00050571);(64.486079,0.00050723);(65.466902,0.000503);(66.182904,0.00052811);(67.05487,0.08310645);(68.049965,0.00106323);(68.058106,0.00076237);(69.034112,0.0546063);(69.045368,0.00048494);(69.070496,0.06892778);(70.029357,0.00055884);(70.065746,0.02225156);(71.049723,0.02378901);(71.086112,0.06302771);(71.088177,0.00075727);(71.316788,0.00051432);(71.982793,0.00239197);(72.044923,0.00637562);(72.081349,0.00618192);(73.029013,0.04778112);(73.047437,0.01614775);(73.065399,0.00294685);(73.541948,0.00053856);(73.600711,0.00050509);(74.060679,0.00127456);(74.096946,0.00319319);(74.688925,0.0005325);(77.804214,0.00050742);(79.021706,0.01674088);(79.054723,0.03751024);(80.050022,0.00205064);(80.948324,0.03517601);(81.00071,0.00066135);(81.019057,0.01836015);(81.033981,0.01351802);(81.070368,0.09820184);(82.065581,0.00418289);(82.073714,0.00168946);(82.945417,0.01508202);(83.022071,0.00113143);(83.049617,0.02348877);(83.086004,0.04724667);(84.044789,0.00378062);(84.081177,0.01011645);(84.089425,0.00074679);(85.028876,0.06090839);(85.065256,0.02650272);(85.101585,0.03677288);(85.578912,0.00057391);(86.060473,0.02925297);(86.096835,0.02426881);(87.044474,0.14654629);(88.076084,0.00271111);(89.060125,0.12688455);(89.525822,0.0005242);(89.583309,0.00054282);(91.039309,0.00050124);(91.054615,0.03021099);(91.057734,0.13678926);(91.061091,0.00089274);(92.057433,0.00173893);(92.966181,0.000479);(92.97493,0.00347726);(93.036976,0.00213622);(93.070246,0.05471073);(94.026714,0.00933404);(94.065378,0.00051918);(94.853514,0.00053935);(95.049464,0.01663299);(95.060614,0.00158498);(95.085882,0.13805586);(95.380304,0.00058139);(96.044679,0.00144348);(96.081,0.00167195);(96.089168,0.00530639);(96.599965,0.00049309);(96.922207,0.01928415);(97.028722,0.0549171);(97.06513,0.02125969);(97.101471,0.02858144);(98.060348,0.00961925);(98.096576,0.00171729);(98.444755,0.00053502);(98.919024,0.00075728);(99.044312,0.01588309);(99.056124,0.00054302);(99.080726,0.01000805);(100.039588,0.01475243);(100.075964,0.02786631);(100.112509,0.00147759);(101.003415,0.01160407);(101.059984,0.00833076);(102.055277,0.00136699);(103.039233,0.14844983);(103.043251,0.00141463);(103.054389,0.00076711);(103.075612,0.01524525);(104.042687,0.00139921);(104.983046,0.00065243);(104.992526,0.00475869);(105.03367,0.01128095);(105.044931,0.00050266);(105.066373,0.00062759);(105.070054,0.02086595);(105.07345,0.0035727);(106.065302,0.02020154);(106.99862,0.0013774);(107.008156,0.01308006);(107.049296,0.01456032);(107.070404,0.00430175);(107.08577,0.04625874);(107.967212,0.0005471);(108.016665,0.01196579);(108.042106,0.00064773);(108.080903,0.00068129);(108.175372,0.00054808);(108.517318,0.00068961);(108.977781,0.00053797);(109.028529,0.00923719);(109.064904,0.01411321);(109.101319,0.05627939);(110.060194,0.00363532);(110.104082,0.00052772);(110.939292,0.00437264);(111.026112,0.00048737);(111.044289,0.00578327);(111.080506,0.00990414);(111.116896,0.00340995);(112.039349,0.003155);(112.075791,0.00280068);(113.059721,0.00361804);(113.096115,0.01073905);(113.107227,0.00050354);(114.055041,0.00203265);(114.091513,0.00293402);(115.024337,0.00154567);(115.03911,0.0198479);(115.075767,0.00056258);(115.086842,0.00069935);(115.795014,0.00052634);(116.052969,0.00383577);(116.07075,0.00405188);(116.991744,0.00053238);(117.070043,0.00179359);(118.065193,0.03084846);(119.049224,0.01165386);(119.085548,0.02213927);(120.080901,0.00297896);(120.089037,0.00077407);(120.226712,0.0005209);(120.98716,0.00136423);(121.0236,0.00561353);(121.028366,0.00152167);(121.03979,0.00094253);(121.064845,0.00650081);(121.101219,0.03480196);(121.497474,0.00049682);(122.060323,0.00064185);(122.096431,0.00064755);(122.104103,0.00065561);(122.939116,0.00771559);(123.044135,0.00093332);(123.08036,0.01040777);(123.116805,0.01967428);(124.075893,0.00062993);(124.937187,0.0005575);(124.964412,0.02272143);(125.022346,0.00054525);(125.059695,0.00230397);(125.096071,0.00632803);(125.935727,0.00398623);(126.054734,0.00101339);(126.091313,0.18142137);(127.038949,0.0062186);(127.075181,0.00063832);(127.094676,0.01043984);(128.070677,0.00053576);(128.106909,0.00244342);(128.752766,0.00048928);(129.012853,0.00070342);(129.052199,0.00206109);(130.158925,0.003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0.00056067);(263.901213,0.00220976);(264.156801,0.01021716);(264.193858,0.00209487);(265.019213,0.02880248);(265.140174,0.00300362);(266.020241,0.00117693);(266.172013,0.00146135);(266.247823,0.00101424);(266.998703,0.22641066);(267.034044,0.00557423);(267.998387,0.02697412);(268.977944,0.01354126);(269.014221,0.03645976);(269.97762,0.00056575);(270.01449,0.00259775);(270.190386,0.00060516);(270.828905,0.00065071);(279.080739,0.00050396);(280.263371,0.00056012);(281.014111,0.01110286);(281.050679,0.01658951);(281.911546,0.05412283);(282.050684,0.00066451);(282.137231,0.00126801);(282.913468,0.0010113);(283.029954,1.0);(284.030037,0.15607047);(284.15271,0.00614344);(284.809437,0.00074775);(285.009194,0.02845828);(285.045567,0.2092255);(285.814835,0.00408902);(286.009104,0.0029727);(286.045611,0.03247697);(286.822369,0.00090383);(287.830355,0.00370099);(288.838354,0.00337786);(294.082998,0.00049492);(294.205044,0.0005835);(294.240493,0.00661949);(294.669428,0.00059569);(295.085016,0.00065841);(295.113436,0.00130849);(295.150908,0.00968164);(295.186395,0.00149933);(295.243632,0.00130967);(295.927583,0.00071368);(296.184105,0.00072369);(296.202447,0.00067591);(296.22011,0.00070245);(296.237427,0.00931812);(296.257453,0.00230875);(296.294279,0.12797523);(296.32986,0.00641986);(296.927376,0.00071314);(297.045727,0.13114962);(297.091492,0.29062665);(297.165768,0.01067485);(297.200759,0.00060706);(297.239856,0.00372994);(297.259225,0.0006005);(297.279599,0.00299808);(297.297086,0.02424852);(298.046037,0.02071707);(298.094843,0.01840437);(298.125613,0.00421927);(298.179714,0.00060859);(298.252699,0.01240805);(298.271781,0.00134116);(298.309601,0.00375378);(298.34631,0.04761657);(299.06116,0.26150864);(300.061553,0.04248267);(300.147698,0.00151702);(301.040275,0.04273678)
LC-MS/MS	LC-ESI-QFT	Positive	high	View Spectrum	(51.75558,0.00067475);(51.940645,0.00478101);(52.284375,0.00061055);(52.912922,0.00074706);(53.002908,0.00904957);(53.039295,0.01814369);(53.678917,0.00062857);(53.998132,0.00079115);(54.53404,0.00069907);(55.018546,0.04400976);(55.054936,0.17541708);(55.216052,0.00067964);(55.681254,0.00082705);(55.830119,0.0007585);(55.935028,0.00248307);(56.05018,0.02833413);(56.058216,0.00149681);(56.142553,0.00067251);(56.965476,0.0509527);(57.034186,0.07585444);(57.070581,0.24190887);(57.935472,0.00094028);(58.037544,0.00146393);(58.065837,0.05716241);(58.073862,0.0047449);(58.95407,0.00092811);(59.04984,0.07608835);(59.243599,0.00072803);(59.930915,0.0012704);(59.9909,0.00138881);(60.045026,0.00267596);(60.217858,0.00062627);(60.951164,0.00422894);(61.011315,0.08084008);(61.029073,0.00970426);(62.019114,0.01774075);(62.982401,0.08825423);(62.990442,0.01120217);(65.039172,0.01645786);(65.232621,0.00071344);(66.004506,0.00068651);(66.276928,0.00070112);(67.05486,0.28267315);(68.050072,0.00945823);(68.058179,0.00757397);(69.026221,0.00069015);(69.032324,0.00228043);(69.03411,0.09146357);(69.036167,0.00136153);(69.070477,0.11173391);(69.624806,0.00068481);(70.029334,0.00407698);(70.065759,0.05881639);(70.073789,0.00087444);(70.283746,0.00078347);(71.009556,0.00079861);(71.01327,0.00522225);(71.04972,0.03230563);(71.08612,0.07251214);(71.110825,0.00071723);(71.982648,0.00360865);(72.04495,0.0184792);(72.081321,0.00900551);(72.903775,0.00065948);(72.937424,0.00085598);(73.028976,0.04395153);(73.047377,0.08023325);(73.06527,0.00095316);(74.060552,0.00404695);(74.096919,0.00932624);(74.931462,0.00085976);(75.026666,0.00156143);(75.044489,0.00093245);(76.409323,0.00060623);(77.006209,0.00069887);(77.008824,0.00188016);(77.235075,0.00072411);(78.967814,0.0009413);(79.021581,0.04320957);(79.023693,0.0007637);(79.05474,0.11921937);(79.389501,0.00075715);(80.049922,0.00957784);(80.058331,0.00093165);(80.662108,0.00089712);(80.948303,0.0349729);(81.000722,0.01539178);(81.019035,0.00286699);(81.033953,0.03072366);(81.036464,0.00073688);(81.070391,0.16025893);(81.986629,0.00069411);(82.029066,0.00071233);(82.037347,0.00100244);(82.065572,0.01843799);(82.073639,0.00526322);(82.945322,0.01310477);(83.049597,0.05067831);(83.085973,0.0398918);(84.044823,0.01437933);(84.081232,0.0286834);(85.026131,0.00108937);(85.028866,0.0676649);(85.065229,0.05482084);(85.101603,0.02361062);(86.060471,0.09969788);(86.096844,0.02657662);(87.041556,0.00123668);(87.044488,0.10176768);(88.076056,0.00464724);(88.997812,0.00165039);(89.060115,0.05206841);(90.948126,0.00341274);(91.054617,0.13853329);(91.057696,0.59840891);(92.057426,0.02323518);(92.061004,0.00844221);(92.974734,0.00108909);(93.036937,0.02627909);(93.070217,0.10434564);(94.026801,0.00080152);(94.065438,0.01058436);(94.073619,0.00424123);(95.016274,0.00565534);(95.049481,0.05057498);(95.052435,0.00079306);(95.060719,0.00693625);(95.08585,0.14829513);(96.015961,0.0008106);(96.04474,0.00193056);(96.081005,0.01174857);(96.089102,0.00625793);(96.922087,0.01094094);(96.99557,0.00991851);(97.028696,0.04674834);(97.039903,0.00455452);(97.065063,0.02699938);(97.101426,0.01086852);(98.060359,0.02714743);(98.096681,0.01036791);(99.011185,0.00204364);(99.044303,0.01206709);(99.842959,0.00072945);(100.039555,0.01272609);(100.075966,0.05905875);(100.112445,0.00089483);(100.504899,0.01451448);(100.508418,0.00086647);(101.003529,0.0007901);(101.059918,0.00092442);(101.298111,0.00069075);(103.039222,0.07575269);(103.054433,0.00477685);(104.042505,0.00068633);(104.992547,0.00769841);(104.999531,0.00073263);(105.033688,0.01398908);(105.044951,0.00301663);(105.069992,0.05471056);(105.073423,0.02171348);(106.06534,0.04001785);(106.073493,0.00079172);(107.008275,0.01179278);(107.049308,0.04916006);(107.060528,0.00069317);(107.072987,0.00085366);(107.085776,0.0533154);(107.512542,0.0010027);(108.016674,0.06333069);(108.081026,0.00496586);(108.517214,0.00187862);(109.028532,0.00539396);(109.064798,0.0154744);(109.068309,0.00294713);(109.076188,0.00075222);(109.101312,0.03870997);(109.510116,0.00193594);(109.722131,0.00072747);(110.060194,0.01177479);(110.096718,0.00172132);(110.935067,0.00085102);(110.93915,0.00613418);(111.026293,0.00085723);(111.043964,0.00306147);(111.080613,0.00595551);(111.457436,0.00081523);(112.039357,0.00303564);(112.075661,0.00329217);(113.034736,0.00078913);(113.20202,0.00070174);(114.055331,0.00187386);(114.52511,0.00073658);(114.833631,0.00066511);(115.024466,0.00144557);(115.039051,0.00120596);(115.054278,0.00282162);(116.026191,0.00071151);(116.966175,0.00099286);(117.069984,0.00986799);(117.964452,0.0007614);(117.985688,0.00072008);(118.065214,0.04539982);(118.901934,0.00083926);(118.971656,0.00418779);(119.049184,0.03013264);(119.085599,0.03073239);(120.08067,0.01055326);(121.023625,0.00733414);(121.028615,0.00194178);(121.039663,0.00538545);(121.064764,0.00745345);(121.101123,0.02384089);(122.060074,0.0021188);(122.096244,0.00087568);(122.939179,0.00692642);(123.043996,0.00208026);(123.055212,0.00073903);(123.080348,0.01095624);(123.11673,0.00283716);(123.946543,0.00208419);(124.075706,0.00389316);(124.112116,0.0008391);(124.748063,0.00090023);(124.936308,0.00092991);(124.964408,0.00367271);(126.091321,0.36463665);(127.038839,0.00088654);(127.094581,0.02447253);(128.062497,0.00093754);(128.106742,0.00207685);(129.069562,0.00074016);(130.065068,0.00452879);(130.158983,0.00074883);(130.506366,0.00301377);(131.007636,0.0080782);(131.049433,0.00068186);(131.07274,0.00079586);(131.085305,0.01393078);(131.93658,0.00072219);(132.080549,0.00765425);(132.95817,0.00205901);(133.064327,0.00251515);(133.101135,0.01209408);(133.516036,0.00077256);(133.560075,0.00070064);(134.059818,0.00404058);(134.096079,0.00335228);(134.815387,0.00081789);(134.978801,0.00104402);(134.996245,0.00151216);(135.002289,0.00069037);(135.043979,0.00087091);(135.080233,0.00474097);(135.116726,0.00646252);(135.445313,0.00068854);(135.676791,0.00076593);(135.999754,0.0007718);(136.06154,0.00117887);(136.075498,0.01168511);(136.13005,0.00069283);(137.011381,0.00379919);(137.059441,0.00099486);(138.054444,0.00079656);(138.09113,0.00517239);(138.510753,0.00078083);(138.673131,0.00077222);(138.963975,0.00503154);(139.050089,0.00244573);(139.923,0.00285714);(139.954146,0.00635818);(140.155984,0.00076838);(141.951439,0.06902828);(142.086134,0.00504333);(142.952092,0.00083638);(143.085301,0.00358862);(143.948349,0.00221568);(144.080754,0.0017494);(144.958505,0.00681646);(145.064766,0.00091669);(145.101124,0.00507217);(146.060238,0.00091584);(146.974103,0.01332802);(146.996442,0.00176158);(147.043621,0.00092026);(147.080502,0.00239866);(147.116106,0.002063);(147.81427,0.00060241);(148.075483,0.00339848);(148.112032,0.00202792);(149.107204,0.00072581);(150.126986,0.00082951);(150.968776,0.00403079);(151.03414,0.00089224);(151.465299,0.00071141);(152.070563,0.00094953);(152.106767,0.00194648);(152.989014,0.01362376);(153.959081,0.005669);(154.947075,0.00084461);(154.977623,0.0553082);(154.984604,0.00237855);(155.021799,0.00271119);(155.954478,0.04267692);(155.967057,0.00171292);(155.978567,0.00626518);(156.176368,0.00068221);(156.488058,0.00077542);(156.499495,0.00065736);(156.974829,0.29715787);(156.981275,0.00441098);(157.95186,0.00499944);(157.964781,0.03043452);(157.97554,0.02680108);(158.05989,0.00230545);(158.971844,0.02757888);(159.961904,0.16432387);(160.075169,0.00312765);(160.962341,0.00912766);(161.095591,0.00145718);(161.13247,0.00082392);(161.959032,0.01046661);(162.091085,0.00090112);(163.026919,0.00125274);(163.038655,0.03757723);(164.352125,0.00074991);(165.049817,0.00828702);(165.35658,0.00067245);(167.51574,0.00093057);(168.081225,0.00086684);(169.075697,0.00078216);(170.11735,0.30242604);(170.973362,0.00081031);(170.990319,0.01543523);(171.120704,0.02896496);(172.957915,0.00133709);(172.988247,0.10108187);(173.97769,0.00437868);(173.989328,0.02067677);(174.956156,0.00888682);(174.971995,0.01362158);(174.985338,0.58112582);(175.985853,0.05804533);(176.982391,0.06661016);(177.0578,0.0012826);(179.954546,0.00083205);(180.887884,0.05587493);(185.078468,0.00549206);(185.94871,0.0008285);(187.003815,0.00075774);(187.944452,0.01734447);(188.96647,0.00084315);(188.988184,0.00074983);(189.000931,0.03481921);(190.969233,0.00082065);(191.033644,0.00093663);(191.206561,0.00075357);(192.966727,0.0109847);(194.903994,0.00106213);(197.890718,0.00457375);(198.898461,0.02450108);(199.039165,0.00098393);(203.142555,0.00383037);(204.146254,0.00480503);(204.887777,0.00110967);(205.14938,0.00719909);(206.977644,0.04943183);(211.026845,0.00598755);(213.005352,0.00078412);(213.885464,0.00202707);(215.901246,0.01467997);(216.136532,0.00082927);(219.174046,0.00368336);(220.177351,0.00427194);(220.282,0.00469425);(221.180771,0.00995049);(222.898259,0.0967878);(223.026979,0.11152338);(223.899571,0.0049339);(224.027119,0.00304436);(225.042603,0.13473291);(226.042997,0.01282795);(226.110461,0.00092883);(227.021788,0.12128833);(228.021765,0.00799384);(229.001046,0.07131289);(229.104477,0.01599978);(230.001265,0.00436655);(231.698681,0.00089369);(236.914289,0.00095631);(238.967115,0.0118466);(239.90137,0.00372299);(240.854482,0.00076383);(240.908895,0.20730503);(241.037256,0.00768088);(241.910257,0.01007617);(247.011713,0.03522282);(248.012949,0.00085401);(248.989134,0.00826869);(250.969418,0.00102774);(251.004256,0.00170908);(251.975532,0.00269946);(252.949635,0.01209815);(252.983059,0.05013215);(253.982874,0.00128683);(254.159862,0.00077437);(254.924338,0.01049212);(254.962261,0.01157287);(254.99877,0.00222697);(256.977143,0.00112519);(261.027619,0.00089318);(264.983001,0.00186401);(265.019776,0.01567102);(266.998652,1.0);(267.998465,0.15312534);(268.978044,0.05142862);(269.01421,0.09984276);(269.977841,0.00276793);(270.014436,0.01238618);(270.827695,0.00125724);(283.029954,0.45969027);(284.030089,0.07745709);(284.80712,0.00375308);(285.009176,0.11287786);(285.027557,0.0010932);(285.045462,0.07470101);(285.815419,0.00582139);(286.009404,0.01332625);(286.04609,0.00803915);(286.822711,0.00089748);(287.830325,0.01063613);(288.838602,0.01459418);(289.866989,0.00086507);(296.237083,0.00398363);(297.046386,0.00202181);(297.091391,0.00683017);(298.252608,0.00386514);(299.024611,0.00096325);(299.061318,0.00454517);(301.040402,0.01450577)

Food Sources

	Name	Group
	Apricot kernel	Fruit, Drupes	Publications	Show
	Cherry pit	Fruit, Drupes	Publications	Show

Role as Biomarker of intake

No roles as Biomarker of intake found

Metabolism

No metabolism information available

Inter-Individual Variations in Metabolism

No data on inter-individual variations available

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Showing entry for Prunasin