precursor

Showing entry for Luteolin 7-O-malonyl-glucoside

Identification

PhytoHub ID
PHUB000898
Name
Luteolin 7-O-malonyl-glucoside
Systematic Name
Not Available
Synonyms
Not Available
CAS Number
Not Available
Average Mass
534.426
Monoisotopic Mass
534.100955388
Chemical Formula
C24H22O14
IUPAC Name
3-{[(2R,3S,4S,5R,6S)-6-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid
InChI Key
MGYBYJXAXUBTQF-FOBVWLSUSA-N
InChI Identifier
InChI=1S/C24H22O14/c25-11-2-1-9(3-12(11)26)15-6-14(28)20-13(27)4-10(5-16(20)37-15)36-24-23(34)22(33)21(32)17(38-24)8-35-19(31)7-18(29)30/h1-6,17,21-27,32-34H,7-8H2,(H,29,30)/t17-,21-,22+,23-,24-/m1/s1
SMILES
O[C@H]1[C@H](O)[C@@H](COC(=O)CC(O)=O)O[C@@H](OC2=CC(O)=C3C(=O)C=C(OC3=C2)C2=CC=C(O)C(O)=C2)[C@@H]1O
Structure
Similar Structures

Calculated Properties

Solubility (ALOGPS)
6.41e-01 g/l
LogS (ALOGPS)
-2.92
LogP (ALOGPS)
1.26
Hydrogen Acceptors
13
Hydrogen Donors
7
Rotatable Bond Count
8
Polar Surface Area
229.73999999999995
Refractivity
122.53479999999996
Polarizability
49.96303142992957
Formal Charge
0
Physiological Charge
-2
pKa (strongest basic)
-3.6491030254425296
pKa (strongest acidic)
3.372997481735943
Number of Rings
4
Rule of Five
No
Bioavailability
No
Ghose Filter
No
Veber's Rule
No
MDDR-like Rule
Yes

Taxonomy as Food Phytochemical

Family
Polyphenols
Class
Flavonoids
Sub-class
Flavones

Spectra from Phytohub

Spectrum TypeInstrument TypeIon ModeCollision Energy LevelViewPeaks
LC-MS/MSLC-ESI-QFTNegativemediumView Spectrum(50.134699,0.00005315);(50.959731,0.00004083);(51.196656,0.00003691);(52.106052,0.00004923);(52.298204,0.00005076);(53.797344,0.00004524);(54.092475,0.00005556);(54.976358,0.00003861);(55.144006,0.00005523);(55.349409,0.00004342);(56.371792,0.00005152);(56.446231,0.00005613);(56.802721,0.00004701);(57.227156,0.00004293);(58.525276,0.00003843);(59.012431,0.00060885);(59.103858,0.00004484);(59.480639,0.00004995);(59.520602,0.00004812);(59.585982,0.00005201);(59.763641,0.00004711);(59.980405,0.00004482);(60.12424,0.00005011);(60.540846,0.0000461);(61.444119,0.00004604);(61.650124,0.00004868);(61.88356,0.00004797);(61.986984,0.00621816);(62.075649,0.00005204);(62.578079,0.00005147);(62.738272,0.00004491);(63.023529,0.00004035);(63.260987,0.00004481);(63.916468,0.00004699);(63.961264,0.00004504);(63.99756,0.00004585);(64.859661,0.00004405);(65.142397,0.0000401);(65.546493,0.00005358);(66.304947,0.00003963);(67.362723,0.0000358);(67.836588,0.00003335);(68.957162,0.00004348);(69.138587,0.00004895);(70.037493,0.00004304);(71.384947,0.00005089);(71.977685,0.0000477);(72.271604,0.00004791);(72.991679,0.00004522);(74.508222,0.00004527);(75.267148,0.00005307);(75.357529,0.00006098);(75.777659,0.00003558);(77.888783,0.00005769);(78.984554,0.0005702);(80.676212,0.00005963);(82.687192,0.0000433);(83.131389,0.00006224);(84.358301,0.00004728);(87.751663,0.00004057);(88.510797,0.00005803);(89.54371,0.00004471);(91.48661,0.000041);(92.682193,0.00004845);(93.075786,0.00004441);(94.19114,0.00004209);(94.979539,0.00427276);(95.019624,0.00004501);(95.024748,0.0000485);(96.853433,0.00005174);(96.958788,0.00125414);(96.97487,0.00005303);(97.239989,0.00004137);(97.559136,0.00004899);(98.86422,0.00004422);(99.444691,0.00003835);(100.479586,0.0000615);(100.775703,0.00004747);(100.932288,0.00032994);(102.256696,0.00003914);(102.461006,0.00003808);(102.887461,0.00005196);(103.217278,0.00004979);(103.343935,0.00004634);(104.749737,0.0000346);(106.498686,0.0000401);(106.596408,0.0000555);(107.012797,0.00003972);(109.184409,0.00005402);(109.877423,0.00005239);(110.974128,0.00007399);(111.399201,0.00005899);(112.30386,0.00005883);(113.081331,0.00003605);(114.155784,0.00005067);(114.376051,0.00005695);(115.541306,0.00004923);(115.919458,0.00105993);(116.910125,0.00005717);(116.927274,0.00020048);(117.005307,0.00004811);(118.074789,0.00005272);(118.532814,0.00005213);(121.610239,0.00004556);(121.765883,0.00004672);(122.012006,0.00006113);(122.838641,0.00006773);(123.064408,0.00006528);(125.023242,0.00016148);(126.119005,0.00003926);(127.036302,0.00005207);(129.437679,0.00004276);(130.072758,0.00006032);(130.626968,0.00003757);(130.943109,0.00029472);(131.467221,0.00005342);(132.653397,0.00004567);(133.028937,0.00020611);(133.421469,0.00004613);(133.576191,0.00003809);(135.043982,0.00249565);(138.025234,0.00005342);(138.312711,0.0000593);(139.145512,0.0000505);(142.490618,0.00004184);(142.778664,0.00004725);(143.694487,0.00005267);(144.805137,0.00004918);(145.617865,0.00006004);(145.991394,0.00004339);(149.023847,0.00005149);(149.942155,0.00004983);(150.996359,0.00005959);(151.002599,0.01376223);(151.164354,0.00003718);(152.006049,0.00042574);(152.056017,0.00004774);(159.806615,0.00005944);(160.858501,0.00005293);(163.375401,0.000041);(164.697599,0.00005238);(165.491063,0.00005807);(167.745424,0.00005608);(169.540898,0.0000489);(169.803007,0.00004771);(172.333779,0.0000526);(175.002718,0.00012995);(175.277772,0.00004612);(175.550147,0.00003818);(178.997086,0.00005488);(179.554958,0.00005928);(179.912854,0.00004373);(181.058799,0.00005409);(183.272076,0.00004455);(186.041798,0.00004746);(193.013795,0.00005182);(193.756459,0.00005632);(200.679751,0.00004232);(202.103676,0.00005237);(202.153004,0.00005778);(206.477315,0.00004835);(209.028611,0.0000483);(209.053008,0.00005303);(213.80527,0.00053694);(213.820423,0.0023044);(213.831635,0.00278451);(213.840379,0.00185628);(213.848916,0.00118093);(213.853371,0.00122087);(213.864344,0.00027974);(217.002435,0.00006588);(217.050095,0.00013499);(219.029669,0.00009419);(224.037015,0.00005464);(224.706958,0.00004473);(225.960652,0.00005248);(226.641355,0.00005914);(231.030778,0.0000754);(235.174124,0.00004615);(239.066799,0.00006729);(243.029771,0.00031724);(249.182867,0.00005347);(250.047475,0.00005365);(253.530367,0.00006358);(255.029541,0.00124779);(255.232775,0.00408962);(256.235736,0.00006228);(259.025388,0.0000721);(269.045081,0.00108156);(270.016884,0.00008237);(270.101706,0.00004524);(271.02484,0.00255952);(273.041239,0.000062);(276.689904,0.00005635);(283.024934,0.0014852);(283.263948,0.00114646);(284.032472,0.03199982);(285.040241,1.0);(286.043624,0.16238783);(287.045089,0.02222178);(288.048324,0.00149694);(297.040511,0.00127807);(298.011794,0.00006864);(299.019745,0.0023681);(299.05592,0.00050336);(299.717808,0.00004535);(300.027076,0.00890839);(301.034526,0.00531161);(302.039141,0.00013645);(303.789307,0.00005406);(308.13328,0.00005405);(309.039609,0.00004432);(311.167977,0.0008824);(311.413041,0.0000684);(313.035362,0.00068804);(325.183855,0.00090821);(327.050895,0.01010856);(328.054649,0.00132821);(339.199504,0.00024352);(352.007235,0.00005849);(357.060232,0.00011341);(362.672654,0.00005248);(372.836826,0.00005066);(390.859005,0.00004407);(420.165032,0.00005329);(436.051399,0.00005827);(441.71392,0.00007107);(447.093436,0.00348888);(447.735907,0.00005096);(448.060135,0.0000518);(448.097257,0.00018114);(454.395795,0.00005596);(461.184418,0.00004564);(487.177369,0.0000445);(493.774219,0.00005854);(494.112888,0.00005763);(494.908569,0.00005651);(508.350241,0.00004381);(528.951557,0.00006359);(546.89181,0.00004386);(572.815193,0.00004307);(575.900907,0.00006105);(579.135869,0.00007347);(580.90712,0.0000591);(593.151406,0.04161687);(594.155018,0.0121812);(595.011867,0.00005652);(595.156862,0.00281412)
LC-MS/MSLC-ESI-QFTPositivemediumView Spectrum(50.726122,0.00004731);(51.220968,0.00005813);(51.809127,0.00005431);(52.710671,0.00006329);(53.943666,0.00005377);(54.115957,0.0000516);(54.16749,0.00004812);(54.206952,0.00005354);(54.259902,0.00005179);(54.527625,0.00005177);(55.054957,0.0001624);(56.126308,0.00005427);(56.469465,0.00005003);(57.034192,0.00603758);(57.0706,0.00462714);(57.585209,0.00005993);(58.849239,0.00006345);(59.049831,0.00008376);(59.061046,0.00033331);(59.929763,0.00006183);(60.163197,0.00006829);(61.011347,0.00461907);(61.492982,0.00006382);(61.838726,0.00005911);(62.019145,0.00085782);(62.85611,0.0000552);(64.659549,0.0000707);(64.820009,0.00005159);(66.033741,0.00004776);(66.818083,0.00005504);(66.895785,0.00005395);(67.055004,0.00004784);(67.828003,0.00004728);(69.07043,0.00029623);(69.081681,0.0000528);(70.808937,0.00004831);(71.049777,0.05161137);(71.051898,0.00024898);(71.08614,0.0036871);(71.176426,0.00005068);(71.590584,0.00005199);(71.810342,0.00005909);(71.86217,0.00006989);(71.888955,0.00016087);(72.053078,0.00104814);(72.796734,0.0000488);(73.028984,0.00093993);(73.065364,0.00065597);(73.746956,0.0000805);(73.808276,0.00006472);(74.991802,0.00005963);(75.044616,0.00159545);(75.560969,0.00006457);(75.7361,0.00005848);(77.201672,0.00005729);(78.064328,0.0000475);(78.4841,0.00006423);(78.594745,0.00005303);(79.021729,0.00632105);(80.054766,0.00018263);(80.371403,0.00005107);(80.61339,0.00005613);(80.658483,0.00006);(81.164472,0.00005755);(81.498547,0.00006638);(83.049618,0.00044075);(83.08599,0.00012409);(83.68428,0.00006509);(83.812693,0.00006052);(84.599266,0.00005346);(85.028945,0.06155262);(85.031955,0.00010961);(85.101676,0.00229861);(85.247949,0.00005546);(85.334739,0.00004814);(86.032224,0.00199258);(86.734948,0.00006814);(87.04448,0.00291787);(88.097978,0.00004872);(89.060174,0.01422373);(90.063536,0.00011364);(91.561685,0.00006268);(91.778988,0.00004949);(92.252154,0.0000749);(95.085935,0.00005502);(97.007289,0.00004736);(97.069147,0.00006652);(97.101438,0.00017297);(98.975852,0.00005578);(99.04419,0.00006758);(99.621194,0.00011482);(99.925477,0.00005328);(100.001105,0.0000632);(100.288897,0.00005638);(100.68058,0.00006274);(101.003449,0.00018603);(101.041706,0.00005811);(101.71804,0.00006433);(102.067746,0.00017519);(102.534341,0.00005138);(102.763184,0.00006266);(103.039438,0.00007365);(103.520237,0.00005409);(103.604577,0.00004836);(104.826262,0.00006084);(105.391555,0.00006826);(106.76076,0.0000652);(108.908986,0.00007334);(111.044227,0.00132446);(111.951182,0.00006144);(112.24664,0.0000709);(113.030408,0.00006661);(113.111961,0.00007137);(113.513286,0.00005442);(114.032376,0.0000658);(114.116379,0.00008004);(114.219536,0.00007936);(117.843375,0.00005452);(119.237611,0.00005045);(120.45477,0.0000482);(121.064685,0.00005204);(121.993535,0.00005032);(123.24596,0.00004983);(123.661191,0.00005805);(125.771471,0.00005476);(126.747262,0.00005994);(129.054715,0.00871276);(132.213122,0.00005349);(133.085923,0.00409047);(134.170332,0.00005854);(135.234202,0.00006124);(138.032424,0.00028993);(141.38052,0.00006049);(141.62194,0.00006223);(142.07,0.00005836);(142.524693,0.00005821);(142.607201,0.00004813);(147.03741,0.00007297);(147.314077,0.00004714);(147.674022,0.00006864);(147.791471,0.00005649);(148.625063,0.00004713);(149.687515,0.00008873);(149.727405,0.00004985);(150.210892,0.00005858);(150.951229,0.00015607);(151.471505,0.00006339);(151.580774,0.00007142);(153.662393,0.00004778);(155.632726,0.00005623);(158.995619,0.00019431);(159.118904,0.00005828);(159.813985,0.00007451);(160.04543,0.00020428);(161.52745,0.0000546);(163.322602,0.00006028);(164.102725,0.00006062);(164.987846,0.00024923);(166.982621,0.00005511);(167.360101,0.00004888);(168.410162,0.00005819);(168.441821,0.00005877);(170.309205,0.00005578);(172.313717,0.00005587);(173.010655,0.00019349);(174.989638,0.0000954);(175.006298,0.00008358);(176.9876,0.00063097);(177.00543,0.00026443);(177.054618,0.00010277);(177.111941,0.00041513);(179.00277,0.00026043);(185.011531,0.0000485);(187.272935,0.00006709);(188.239792,0.00005942);(189.005429,0.00038216);(189.489757,0.00007583);(189.677873,0.00006198);(191.052276,0.00005983);(191.652933,0.00007122);(192.413994,0.00006458);(192.961457,0.00099629);(195.783674,0.00006159);(198.928214,0.00007662);(200.194511,0.00006293);(200.716321,0.00008005);(203.021385,0.00010168);(204.960948,0.00005513);(205.016063,0.00006336);(207.053959,0.00007191);(207.309023,0.00005672);(209.08185,0.00005459);(209.428627,0.0000615);(210.972338,0.00015187);(213.669538,0.00086822);(213.675314,0.00066268);(213.680817,0.00064505);(213.694374,0.00271804);(213.701471,0.00203923);(213.711018,0.00255946);(213.717152,0.00308975);(213.729639,0.00258776);(213.747248,0.00041017);(219.017741,0.000066);(219.174172,0.00013112);(226.519613,0.00006538);(229.067455,0.0000572);(229.896298,0.00012616);(232.080806,0.0000517);(233.070049,0.0001378);(234.370228,0.00005895);(237.873009,0.00006142);(245.337458,0.00006269);(245.559434,0.0000606);(245.891474,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LC-MS/MSLC-ESI-QFTNegativehighView 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LC-MS/MSLC-ESI-QFTNegativehighView Spectrum(50.083413,0.00037966);(50.340176,0.00056669);(50.726676,0.00046691);(50.864759,0.0005047);(51.017796,0.00054878);(51.047907,0.00038966);(51.257864,0.00047522);(51.484514,0.00043107);(51.793224,0.00046769);(52.646632,0.0004087);(52.691915,0.00047199);(53.519209,0.00041715);(53.918945,0.00044685);(55.785777,0.00050818);(56.227135,0.00064636);(56.256442,0.00047378);(56.547617,0.00056252);(56.904277,0.0004385);(57.057582,0.00044021);(57.154281,0.00042459);(57.601748,0.00043374);(58.05649,0.00032746);(58.173826,0.00033327);(58.328193,0.00041199);(58.847699,0.00045425);(58.905,0.00044131);(59.012442,0.00350854);(59.143313,0.00053716);(59.187589,0.00033495);(60.015396,0.00032465);(61.68888,0.00031892);(61.986994,0.02752634);(62.090723,0.00046895);(63.02266,0.09991773);(63.259233,0.0004441);(63.278472,0.00041236);(63.640538,0.00042663);(63.961074,0.00287445);(64.405093,0.00046784);(65.001914,0.07701925);(65.925148,0.00060503);(66.292173,0.00051728);(67.207656,0.00046772);(67.525673,0.00046142);(68.202523,0.00045583);(69.128496,0.00044269);(70.466614,0.0004771);(70.543592,0.00043529);(71.649172,0.00043891);(72.681366,0.00040204);(73.935309,0.00050208);(74.887463,0.00037605);(75.730561,0.00037056);(77.382103,0.00048356);(78.475184,0.00045493);(78.838107,0.0005571);(79.705848,0.00040575);(79.900805,0.00061955);(79.956075,0.00569662);(79.982474,0.00041359);(80.407259,0.00042444);(81.033372,0.00178535);(82.025051,0.00045434);(82.045857,0.00053966);(83.012516,0.04939913);(84.468673,0.00048992);(85.692618,0.00042494);(87.406772,0.00053357);(88.016471,0.00056346);(89.002486,0.00038862);(89.017169,0.00051393);(89.289724,0.00036745);(89.844717,0.00048526);(89.886351,0.00057656);(90.6779,0.00047756);(91.049294,0.00040549);(94.067632,0.00043208);(94.979586,0.013887);(95.012486,0.00053759);(95.193375,0.00057432);(95.780181,0.00040462);(96.212815,0.00044672);(96.822264,0.00044398);(96.958761,0.00254566);(98.236787,0.00045913);(98.336501,0.00046441);(99.128566,0.00043382);(99.393031,0.00046409);(99.924605,0.00144665);(100.773897,0.0005388);(100.932358,0.00038556);(103.731472,0.00046314);(103.865963,0.00055686);(104.072857,0.0005586);(104.852186,0.00042457);(105.033293,0.02664342);(105.044448,0.00041434);(105.122724,0.00065372);(107.012576,0.1508663);(107.487375,0.00035543);(107.658087,0.0005274);(108.01609,0.00399682);(108.02054,0.00103351);(108.718329,0.00038211);(109.02831,0.05409969);(109.512015,0.00041069);(109.963867,0.00046715);(110.031372,0.00045555);(110.28416,0.00038129);(111.322602,0.00048068);(111.377089,0.00048573);(111.898976,0.00041577);(112.019197,0.00053454);(113.637442,0.00044066);(114.621749,0.0004553);(115.000174,0.00050945);(115.919351,0.00602662);(116.927583,0.00048762);(116.943104,0.00038699);(117.455846,0.00039662);(119.049259,0.0007775);(120.658996,0.00034433);(121.028316,0.04881004);(122.138415,0.00055215);(123.021052,0.00039419);(124.880978,0.00045454);(125.023258,0.00271932);(126.17376,0.00043352);(126.688857,0.00034573);(126.862004,0.00048261);(127.158944,0.00060466);(128.637247,0.00040265);(131.456486,0.00056639);(132.020692,0.0059793);(132.397135,0.0004708);(133.022974,0.00161217);(133.028343,0.34008447);(133.131719,0.00056199);(134.031603,0.02340752);(134.036419,0.0202553);(135.007691,0.00179566);(135.044075,0.04174108);(135.372226,0.00070165);(139.038546,0.00078601);(140.439995,0.00062272);(140.661858,0.00043895);(140.764115,0.00045058);(140.891569,0.00055428);(141.643393,0.00045252);(143.049209,0.00983291);(144.051852,0.00041371);(144.483116,0.00036963);(145.028394,0.00190962);(146.036597,0.00058956);(147.007899,0.0010544);(147.044233,0.00366742);(148.015609,0.00858667);(148.587437,0.00067883);(149.023383,0.09578064);(149.994811,0.00460025);(150.026776,0.00356378);(151.002572,0.25747665);(151.038984,0.00717391);(151.150894,0.00044812);(152.005891,0.01129918);(153.283785,0.00043565);(153.834239,0.00035785);(155.049294,0.00053234);(157.028601,0.00158687);(157.064894,0.00102938);(157.411127,0.00043356);(158.037025,0.00056645);(159.043997,0.0021436);(163.002881,0.00040928);(167.049265,0.00235849);(168.84502,0.00041687);(169.013423,0.00624755);(169.064988,0.00366245);(169.890923,0.00040166);(171.044313,0.02241341);(172.967298,0.0004248);(173.023492,0.00099123);(173.0598,0.00529238);(174.031449,0.00408413);(175.039196,0.11415008);(175.626025,0.00052782);(176.042592,0.00667715);(177.018465,0.02504545);(177.333522,0.00037562);(179.080017,0.00040097);(180.098203,0.00047212);(180.798313,0.0004133);(183.01131,0.00643241);(183.044326,0.01313347);(183.126675,0.00047322);(185.060065,0.0316933);(186.063963,0.00111042);(186.393891,0.00040659);(186.408725,0.00051401);(186.694694,0.00052038);(187.039446,0.01257264);(187.884202,0.00051214);(187.940755,0.00048516);(188.047168,0.0024664);(189.055038,0.00839563);(193.155369,0.00036286);(195.044627,0.00473943);(196.052536,0.00039159);(197.06018,0.01218138);(198.03166,0.01705014);(199.039432,0.12740703);(200.045658,0.00900102);(200.563947,0.00046938);(201.018749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LC-MS/MSLC-ESI-QFTPositivehighView 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LC-MS/MSLC-ESI-QFTPositivehighView Spectrum(50.230115,0.00015297);(50.56364,0.00016286);(50.576493,0.00014617);(50.735436,0.0001436);(51.673722,0.00009541);(51.940674,0.00029962);(52.017179,0.00014854);(52.169181,0.00017519);(52.533881,0.00014467);(52.651244,0.00016497);(53.076778,0.0001636);(53.269724,0.00009462);(53.478556,0.00017675);(53.676814,0.00013138);(53.708752,0.00011862);(53.72734,0.00013733);(54.283,0.00013716);(54.295745,0.00015726);(54.442703,0.00024361);(54.513137,0.00010498);(55.054953,0.00228835);(55.635391,0.00017245);(55.827678,0.00016436);(55.935084,0.0005221);(56.935969,0.00015579);(56.965513,0.02679398);(57.03419,0.01199111);(57.070602,0.00759447);(57.272156,0.00012116);(57.703988,0.00016045);(57.935499,0.00013411);(58.625177,0.00014674);(58.692779,0.00018053);(59.049832,0.00024197);(59.061193,0.00011764);(59.589359,0.00017505);(59.683596,0.00012047);(59.845708,0.00011943);(60.538702,0.00014617);(61.011353,0.03205474);(61.076401,0.00012313);(61.468283,0.00011925);(61.678484,0.00015225);(62.014799,0.00013663);(62.01912,0.00076845);(62.615582,0.00011384);(63.007233,0.0002691);(63.564097,0.0001869);(63.589102,0.00014171);(63.864183,0.00016826);(64.12974,0.00011986);(64.319627,0.00016518);(65.248713,0.00009907);(66.166781,0.00009489);(66.295515,0.00013036);(66.876596,0.0001731);(67.018515,0.01657718);(67.020231,0.00009635);(67.05489,0.00020543);(67.068688,0.00015609);(67.673745,0.00012567);(67.700311,0.0001389);(67.935486,0.00019322);(68.022012,0.0001435);(68.997746,0.01160528);(69.034155,0.00027196);(69.070537,0.00055762);(69.178913,0.00010196);(69.514094,0.00015663);(70.958348,0.00010804);(71.04979,0.03708375);(71.086197,0.00101503);(71.796708,0.00009478);(72.431707,0.00019609);(72.784317,0.00015813);(72.80188,0.00010241);(72.937709,0.00231757);(73.028996,0.00140229);(73.190062,0.0001765);(73.752035,0.00015854);(74.355338,0.00018412);(74.375407,0.00018348);(76.567465,0.00014827);(77.221698,0.00016275);(78.237616,0.00015451);(78.546565,0.00009773);(78.598116,0.00017575);(78.648597,0.00012754);(79.021737,0.00480205);(79.054757,0.00079795);(79.3373,0.00013408);(79.694419,0.00018812);(79.816443,0.00014569);(80.378815,0.00015082);(80.524552,0.00017664);(81.034087,0.00024692);(81.040057,0.00017668);(81.070428,0.00034828);(81.616287,0.00014004);(81.787135,0.00014207);(82.659486,0.00010183);(82.762871,0.00021507);(83.049728,0.00072859);(83.220921,0.00014803);(83.539429,0.00014693);(83.808113,0.00015336);(83.907885,0.00012969);(85.028936,0.03143505);(85.10469,0.0001771);(86.373988,0.00014306);(87.044628,0.00027649);(87.515018,0.00012314);(87.566644,0.00017905);(88.051792,0.00016864);(88.898915,0.00011454);(88.908402,0.00012495);(89.039027,0.00211853);(89.060105,0.00240759);(89.43691,0.00012416);(89.587447,0.00013324);(89.711595,0.0001617);(90.823507,0.00014172);(90.832564,0.00013397);(90.948119,0.00054356);(91.054683,0.0028304);(91.057742,0.00014953);(91.31752,0.00014578);(92.45067,0.00016935);(93.070323,0.00011628);(93.611352,0.0001189);(94.282417,0.00012129);(94.366627,0.00012534);(94.461394,0.00015651);(95.085829,0.00025724);(95.41781,0.00012694);(97.028821,0.00013198);(97.600393,0.00013351);(97.911291,0.00014666);(98.263387,0.0001852);(98.854757,0.00019292);(98.857526,0.00013116);(98.859723,0.00023639);(98.975646,0.00670702);(99.18774,0.0000943);(103.054139,0.00009473);(104.633576,0.0001232);(105.037005,0.00016308);(105.07011,0.00050621);(105.724276,0.00015305);(106.904142,0.00013281);(107.049489,0.00062111);(109.02871,0.00012374);(111.007858,0.00019516);(111.04426,0.00060085);(112.366494,0.00018949);(112.802542,0.00012139);(112.840213,0.00012881);(113.762476,0.00013117);(114.189289,0.00014175);(115.520957,0.00014447);(116.985909,0.00457757);(117.033592,0.00295982);(117.190611,0.00015096);(118.06825,0.00016921);(119.001435,0.00072144);(119.085728,0.00010552);(119.470876,0.0001182);(120.37513,0.00019685);(120.935989,0.00014975);(120.940458,0.00013012);(121.720401,0.00021345);(122.940928,0.00013338);(123.102011,0.00014971);(125.236932,0.00012244);(125.31306,0.00011622);(127.039007,0.00018775);(127.694319,0.00022737);(128.71364,0.00014141);(128.963641,0.00029008);(129.018185,0.0037847);(129.069497,0.00016019);(130.123965,0.00015668);(131.000416,0.00040528);(131.13155,0.00014392);(131.302739,0.00010496);(131.440822,0.00010142);(131.502411,0.00016519);(132.222654,0.00013372);(132.958347,0.00104086);(133.645734,0.00011989);(133.703836,0.00012158);(134.577018,0.00018158);(134.907481,0.00012734);(134.933771,0.00015779);(134.955921,0.00046525);(134.996297,0.00050937);(135.044056,0.05395778);(136.047123,0.0014184);(136.866627,0.00016118);(137.023263,0.01720693);(138.026908,0.00019324);(138.68839,0.00012437);(138.951494,0.00010624);(140.081735,0.00012885);(143.000329,0.00042637);(143.844587,0.00010619);(144.746643,0.00014781);(145.100963,0.00012411);(145.212268,0.00014256);(146.974224,0.00966211);(147.627748,0.00013069);(147.974092,0.00018213);(148.972251,0.00013276);(150.950901,0.00164378);(150.968435,0.00065313);(151.625166,0.00014416)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Food Sources

No food source information available

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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