precursor metabolite

Showing entry for Maslinic acid

Identification

PhytoHub ID
PHUB000175
Name
Maslinic acid
Systematic Name
Not Available
Synonyms
Not Available
CAS Number
Not Available
Average Mass
472.71
Monoisotopic Mass
472.355260026
Chemical Formula
C30H48O4
IUPAC Name
(4aS,6aS,6bR,8aR,10R,11R,12aR,12bR,14bS)-10,11-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid
InChI Key
MDZKJHQSJHYOHJ-LLICELPBSA-N
InChI Identifier
InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)/t19-,20+,21-,22+,23-,27-,28+,29+,30-/m0/s1
SMILES
[H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)C[C@@H](O)[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(O)=O
Structure
Similar Structures

Calculated Properties

Solubility (ALOGPS)
4.04e-03 g/l
LogS (ALOGPS)
-5.07
LogP (ALOGPS)
6.06
Hydrogen Acceptors
4
Hydrogen Donors
3
Rotatable Bond Count
1
Polar Surface Area
77.75999999999999
Refractivity
134.98600000000002
Polarizability
55.85611327924355
Formal Charge
0
Physiological Charge
-1
pKa (strongest basic)
-3.1598164618201197
pKa (strongest acidic)
4.744259192011683
Number of Rings
5
Rule of Five
No
Bioavailability
Yes
Ghose Filter
No
Veber's Rule
No
MDDR-like Rule
No

Taxonomy as Food Phytochemical

Family
Terpenoids
Class
Triterpenoids
Sub-class
Miscellaneous triterpenoids

Taxonomy as Metabolite

Metabolite Family
Terpenoid metabolites
Metabolite Class
Miscellaneous terpenoid metabolites
Metabolite Sub-class
Miscelleanous triterpenoid metabolites

Taxonomy of its Food Phytochemical Precursor(s)

Food PhytochemicalFamilyClassSub-class
Maslinic acidTerpenoidsTriterpenoidsMiscellaneous triterpenoidsShow Food Phytochemical

Spectra from Phytohub

Spectrum TypeInstrument TypeIon ModeCollision Energy LevelViewPeaks
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(81.06983,0.13813814);(84.08685,0.11311311);(94.07217,0.13813814);(95.08371,0.8048048);(105.0676,0.10710711);(105.0743,0.55955956);(106.07661,0.22022022);(107.08644,0.2962963);(108.0907,0.10710711);(111.1199,0.12612613);(119.08116,0.23923924);(119.08658,1.0);(121.10239,0.67267267);(131.07797,0.15115115);(133.10095,0.57857858);(133.10681,0.34034034);(134.1026,0.11311311);(135.11348,0.44744745);(137.10097,0.12612613);(145.10081,0.50850851);(147.12173,0.12612613);(149.06409,0.10710711);(149.12885,0.15115115);(149.13936,0.13813814);(154.33136,0.25825826);(159.11395,0.14514515);(161.11638,0.2012012);(161.13629,0.15115115);(163.10753,0.13813814);(163.15308,0.32732733);(169.1037,0.17617618);(171.11743,0.13213213);(173.1313,0.28928929);(173.13689,0.11911912);(174.14555,0.10710711);(175.14124,0.28928929);(176.15509,0.13213213);(177.15585,0.10710711);(178.17033,0.11911912);(186.1413,0.11311311);(187.1492,0.28928929);(189.16217,0.10710711);(201.16034,0.12612613);(205.16037,0.10710711);(206.16899,0.18918919);(231.18178,0.10710711)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(71.06963,0.07707708);(107.08249,0.06406406);(121.10465,0.08708709);(123.10526,0.07707708);(133.10515,0.15115115);(135.1165,0.06406406);(137.13234,0.05505506);(147.11588,0.07407407);(147.12146,0.05805806);(149.12863,0.05805806);(161.13533,0.1961962);(163.14793,0.14114114);(164.15503,0.07707708);(173.12798,0.06106106);(175.13443,0.07407407);(175.14763,0.06406406);(177.16472,0.14514515);(178.15854,0.08708709);(185.13341,0.06406406);(187.14854,0.12912913);(189.1628,0.1031031);(189.1687,0.21221221);(191.18356,0.11911912);(192.19316,0.06406406);(193.16087,0.11611612);(201.16898,0.05805806);(203.16878,0.09009009);(203.179,0.26426426);(203.19046,0.1031031);(204.18051,0.07707708);(204.1913,0.07107107);(205.1539,0.06106106);(205.16736,0.11911912);(205.19719,0.11611612);(206.15448,0.06406406);(207.17291,0.1961962);(207.18587,0.11911912);(208.18057,0.13213213);(216.17879,0.06806807);(222.19405,0.07407407);(231.17532,0.09009009);(233.19249,0.06806807);(247.16046,0.05505506);(267.17273,0.06406406);(324.28058,0.07707708);(349.28433,0.08008008);(375.46722,0.07107107);(381.34262,0.07107107);(391.33182,0.06806807);(392.33908,0.18318318);(409.33063,0.19019019);(409.34772,1.0);(409.35947,0.28328328);(410.34534,0.17017017);(410.36133,0.2992993);(410.37891,0.05505506);(411.32861,0.06106106);(411.36859,0.15815816);(412.34894,0.09309309);(427.36331,0.12212212);(437.32886,0.37637638);(437.35199,0.14114114);(438.34506,0.05805806);(439.32047,0.05805806);(439.35138,0.06406406);(439.36945,0.07107107);(455.33713,0.11611612);(455.36435,0.14514515);(473.34592,0.32232232);(473.36807,0.61661662)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(67.05228,0.12112112);(81.06708,0.10610611);(93.07102,0.23223223);(95.07835,0.1011011);(105.06613,0.28328328);(105.07317,0.17217217);(106.08028,0.0960961);(107.08072,0.30830831);(107.08905,0.23223223);(109.10473,0.1011011);(119.0866,0.54454454);(121.10089,0.08608609);(121.1088,0.1011011);(122.09293,0.13613614);(125.10072,0.16716717);(133.09613,0.27327327);(133.11473,0.08608609);(134.10971,0.14114114);(135.11542,0.18218218);(136.11908,0.25825826);(138.13928,0.12612613);(145.09088,0.11111111);(145.10513,0.42942943);(147.11841,1.0);(149.08363,0.13613614);(159.10686,0.12612613);(161.13148,0.21721722);(163.15111,0.1011011);(164.08105,0.10610611);(173.12961,0.09109109);(174.13963,0.09109109);(175.14865,0.27327327);(177.13014,0.08608609);(177.16484,0.23223223);(189.16243,0.17217217);(201.15462,0.08608609);(203.1855,0.08608609);(204.19177,0.14114114);(205.15602,0.0960961);(216.18291,0.21221221)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(67.04485,0.07807808);(77.75529,0.05905906);(93.07038,0.07007007);(107.08721,0.07507508);(109.10569,0.08408408);(119.08836,0.12312312);(121.10625,0.05605606);(135.12175,0.07307307);(147.11005,0.1011011);(147.11864,0.2012012);(163.11024,0.04704705);(163.15482,0.08908909);(167.13312,0.05605606);(175.14978,0.1961962);(177.16492,0.12612613);(187.15041,0.12812813);(189.15225,0.16216216);(189.16516,0.13713714);(189.17564,0.05605606);(190.16283,0.07007007);(192.18484,0.06106106);(193.12349,0.05605606);(193.18767,0.06106106);(201.15953,0.17917918);(202.1758,0.05005005);(202.78622,0.05605606);(203.1819,0.69269269);(204.18776,0.05905906);(205.16371,0.1031031);(207.15611,0.06706707);(207.1759,0.3023023);(208.18382,0.05305305);(219.18457,0.1031031);(221.18936,0.06406406);(229.20068,0.06706707);(231.17184,0.06706707);(231.20264,0.07007007);(232.22101,0.08708709);(233.18562,0.05605606);(235.17422,0.07007007);(241.20341,0.05605606);(247.16359,0.05905906);(249.17505,0.05605606);(249.18546,0.06106106);(271.22977,0.04704705);(293.20984,0.06106106);(295.25055,0.07007007);(329.12543,0.05605606);(409.32565,0.1031031);(409.34811,1.0);(409.37372,0.05605606);(410.35385,0.25125125);(411.36145,0.06406406);(427.35141,0.05305305);(427.3642,0.07807808);(429.3674,0.06106106);(437.33179,0.14514515);(437.34863,0.14214214);(438.35669,0.05605606);(439.30353,0.05605606);(455.33563,0.12812813);(458.37769,0.04704705);(473.36722,0.35835836)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(163.27628,0.01801802);(189.16043,0.01301301);(189.16599,0.02102102);(203.18849,0.01801802);(207.17726,0.05405405);(207.19249,0.01601602);(229.18742,0.01501502);(250.18678,0.04004004);(260.18912,0.01201201);(391.34109,0.01401401);(394.35645,0.01201201);(409.29819,0.01301301);(409.31894,0.01901902);(409.35043,0.31231231);(410.33469,0.01201201);(410.35324,0.05305305);(410.36847,0.04704705);(412.25479,0.02002002);(412.35406,0.01401401);(424.05377,0.01401401);(427.34152,0.01601602);(427.36139,0.02602603);(428.38785,0.03003003);(430.362,0.01401401);(437.3075,0.01801802);(437.33359,0.14114114);(438.1954,0.01201201);(438.31982,0.01501502);(438.34872,0.10810811);(439.34879,0.01501502);(455.3454,0.13913914);(455.36383,0.11011011);(455.55386,0.01601602);(456.33182,0.01301301);(456.35843,0.15615616);(471.32825,0.01201201);(473.29688,0.02102102);(473.30936,0.01401401);(473.36307,1.0)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(93.07096,0.04304304);(95.08321,0.10510511);(98.07159,0.06906907);(107.08492,0.04804805);(109.10237,0.06106106);(109.11391,0.04604605);(119.08769,0.10510511);(120.20555,0.05605606);(121.08392,0.05605606);(123.11667,0.04604605);(129.60979,0.05105105);(133.10245,0.18618619);(135.08144,0.06406406);(147.11159,0.05405405);(147.12173,0.07707708);(148.1147,0.05405405);(149.13396,0.10710711);(151.14297,0.06106106);(161.13362,0.04604605);(161.13831,0.08208208);(163.12215,0.06106106);(166.09142,0.05105105);(169.12744,0.04804805);(173.13504,0.06406406);(175.14668,0.0970971);(177.12115,0.04804805);(177.12924,0.05405405);(177.16669,0.16316316);(177.17476,0.08908909);(178.16545,0.04804805);(181.36041,0.05105105);(185.09766,0.04604605);(187.1489,0.06106106);(189.155,0.18118118);(189.16528,0.4034034);(189.1776,0.11511512);(191.17792,0.05405405);(191.18842,0.04604605);(201.15961,0.04304304);(201.16838,0.13313313);(201.28159,0.06906907);(202.16779,0.04804805);(203.0043,0.05605606);(203.17838,1.0);(204.16313,0.04304304);(204.18614,0.05105105);(205.15807,0.32932933);(205.19049,0.06106106);(207.17957,0.05105105);(213.16531,0.06106106);(217.1953,0.04604605);(218.20737,0.05105105);(219.18352,0.05605606);(219.20845,0.04604605);(245.19102,0.05105105);(249.14693,0.07407407);(261.22192,0.05405405);(321.26068,0.07407407);(321.27832,0.04304304);(339.26083,0.05405405);(367.30478,0.05905906);(391.32651,0.04304304);(391.34641,0.05105105);(409.34821,0.10510511);(410.33939,0.04604605);(427.36493,0.05105105);(427.38263,0.06606607);(428.37305,0.04304304);(437.34564,0.0970971)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(163.13805,0.02302302);(189.14961,0.02602603);(189.16508,0.05005005);(205.14424,0.01701702);(207.17929,0.16116116);(208.17415,0.01701702);(208.1828,0.02902903);(209.16246,0.01901902);(249.18118,0.02202202);(293.21881,0.02002002);(314.17084,0.02802803);(320.30814,0.01901902);(403.78348,0.01901902);(409.31244,0.02602603);(409.34799,0.46646647);(410.34317,0.06106106);(411.3598,0.01901902);(424.24734,0.01701702);(427.34109,0.01701702);(427.38016,0.04304304);(437.29297,0.01901902);(437.33545,0.07907908);(437.34888,0.06006006);(437.36951,0.02702703);(438.3548,0.01901902);(439.36548,0.01701702);(455.34607,0.3023023);(456.08899,0.02302302);(456.36392,0.03003003);(457.35846,0.06706707);(473.31644,0.02302302);(473.3616,1.0)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(97.09187,0.03803804);(107.08638,0.13113113);(119.08273,0.07707708);(123.11967,0.03803804);(133.10112,0.04004004);(133.10725,0.05105105);(135.1172,0.03803804);(147.11241,0.07307307);(151.13673,0.04904905);(160.10558,0.06606607);(163.14139,0.08408408);(163.15057,0.05505506);(164.1519,0.04604605);(171.11177,0.04604605);(175.14572,0.05805806);(177.15764,0.04604605);(177.16772,0.04004004);(189.1474,0.03803804);(189.15852,0.05305305);(189.16974,0.11911912);(190.16252,0.04004004);(191.1769,0.06006006);(201.1655,0.0970971);(203.16989,0.15315315);(203.17923,0.41441441);(203.19174,0.07107107);(204.1832,0.0970971);(205.16098,0.29029029);(206.16463,0.04404404);(207.17413,0.20620621);(220.12651,0.05305305);(223.16824,0.04004004);(229.19743,0.04404404);(235.16422,0.06006006);(235.21356,0.06206206);(243.21599,0.04904905);(249.18669,0.09109109);(259.3147,0.04604605);(321.25079,0.04204204);(381.37167,0.05505506);(383.37445,0.04404404);(389.30997,0.07307307);(391.34558,0.06406406);(392.33115,0.05305305);(409.26425,0.07307307);(409.34589,1.0);(409.36108,0.20620621);(410.33447,0.08408408);(410.35156,0.21921922);(411.36578,0.08008008);(412.34042,0.04004004);(412.36252,0.12212212);(425.35208,0.05105105);(427.35663,0.14214214);(429.34991,0.04404404);(430.34189,0.04004004);(437.34726,0.2042042);(438.05432,0.05305305);(438.33908,0.04604605);(438.3587,0.04404404);(455.33813,0.14414414);(455.35803,0.13313313);(456.34818,0.12412412);(457.35828,0.05505506);(458.71094,0.03803804);(473.36838,0.48948949)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(149.12869,0.02802803);(163.15479,0.01601602);(190.16762,0.01301301);(203.1777,0.02202202);(204.19345,0.01901902);(205.15076,0.01301301);(205.16237,0.01601602);(207.17213,0.09209209);(208.1813,0.03203203);(220.29178,0.02402402);(221.15283,0.01701702);(241.16537,0.01701702);(248.18181,0.01701702);(317.66071,0.02002002);(353.01251,0.02202202);(372.58826,0.01601602);(391.33917,0.01301301);(409.28714,0.01301301);(409.33395,0.12412412);(409.35104,0.35235235);(410.34576,0.04604605);(410.36212,0.01901902);(411.33661,0.03603604);(427.38849,0.01401401);(428.35583,0.01701702);(429.38303,0.01801802);(437.31491,0.01701702);(437.33731,0.03203203);(437.35663,0.04104104);(438.33817,0.04704705);(438.37579,0.02402402);(447.20572,0.01401401);(449.00803,0.01401401);(455.34531,0.1981982);(455.39276,0.01301301);(456.33221,0.01801802);(456.35303,0.05005005);(473.36041,1.0);(473.38425,0.16216216)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(81.06402,0.04004004);(81.07502,0.04704705);(95.08821,0.07207207);(95.0913,0.03603604);(97.08909,0.04004004);(105.06356,0.03603604);(105.52493,0.05705706);(107.08669,0.08308308);(119.08491,0.09109109);(121.09966,0.04504505);(133.10416,0.03603604);(135.10008,0.03803804);(135.10902,0.04504505);(136.1144,0.04504505);(142.04927,0.04204204);(147.11388,0.03803804);(149.12416,0.04904905);(150.14319,0.04204204);(151.15285,0.03603604);(153.08855,0.04004004);(153.09874,0.03603604);(157.09262,0.03803804);(159.10408,0.07207207);(161.12758,0.04204204);(161.1366,0.08508509);(162.13815,0.04904905);(163.10358,0.04204204);(163.11157,0.03803804);(163.11934,0.04504505);(163.14543,0.04704705);(163.15105,0.11011011);(164.12462,0.04504505);(165.11952,0.03603604);(175.13492,0.03803804);(175.14998,0.12712713);(176.15546,0.05105105);(177.12376,0.04204204);(177.15543,0.03803804);(177.1692,0.17617618);(178.15993,0.04704705);(179.14043,0.04204204);(179.16902,0.04004004);(187.11084,0.03603604);(187.14944,0.13813814);(187.21254,0.08708709);(187.33141,0.03803804);(189.15501,0.16616617);(189.16811,0.17817818);(190.16019,0.04704705);(191.17828,0.03803804);(191.18617,0.03603604);(191.38678,0.03603604);(192.17892,0.05305305);(192.19223,0.04904905);(201.16138,0.03803804);(201.17082,0.15915916);(203.13849,0.04504505);(203.16559,0.07607608);(203.17972,1.0);(204.14003,0.04504505);(204.17929,0.17017017);(205.15115,0.21921922);(205.1666,0.18018018);(206.16083,0.03803804);(207.17323,0.12112112);(207.17966,0.04004004);(208.18288,0.03803804);(211.1384,0.05105105);(213.17111,0.1021021);(215.1633,0.03603604);(219.14059,0.03603604);(219.17062,0.13613614);(219.20435,0.04204204);(221.19246,0.05705706);(227.17981,0.03603604);(229.20415,0.04904905);(230.20018,0.04704705);(248.68877,0.04904905);(249.17407,0.05705706);(249.19241,0.04204204);(252.19595,0.04004004);(255.21219,0.05305305);(266.694,0.05305305);(271.11081,0.03803804);(325.28192,0.03803804);(353.29007,0.06406406);(367.34821,0.03603604);(381.3631,0.11711712);(384.36911,0.04904905);(409.33835,0.19319319);(409.3541,0.08308308);(410.33551,0.04904905);(410.35056,0.07907908)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(69.07071,0.12612613);(95.08634,0.33533534);(105.06815,0.62062062);(107.08443,0.08308308);(108.09124,0.21821822);(109.10128,0.09209209);(117.06863,0.1021021);(119.08626,1.0);(121.10371,0.16016016);(122.10711,0.22322322);(131.08591,0.09209209);(133.0988,0.26226226);(133.1084,0.08308308);(135.0394,0.0970971);(141.07304,0.13613614);(145.09071,0.08308308);(145.10265,0.55755756);(145.11285,0.10710711);(147.11942,0.54354354);(148.08359,0.09209209);(150.12811,0.08708709);(158.11398,0.08308308);(159.11725,0.18918919);(161.1357,0.39339339);(165.12695,0.10710711);(177.12306,0.08308308);(177.168,0.28228228);(187.14369,0.19419419);(189.16603,0.1991992);(201.16344,0.17517518);(203.175,0.17017017);(203.18581,0.08708709);(213.15822,0.21421421)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(79.05878,0.07007007);(95.08423,0.07407407);(105.06573,0.03303303);(107.07852,0.13613614);(121.10629,0.03903904);(135.11961,0.12012012);(149.1378,0.11711712);(154.09271,0.04104104);(159.11177,0.03503504);(159.11917,0.05405405);(163.10843,0.03503504);(163.14435,0.06206206);(163.15318,0.09109109);(167.11638,0.03303303);(171.12489,0.04904905);(173.12915,0.08308308);(175.1463,0.03703704);(177.15628,0.04104104);(177.17357,0.04904905);(178.14919,0.05605606);(178.16829,0.07607608);(179.14197,0.03303303);(187.14232,0.08908909);(187.15155,0.14014014);(187.1586,0.03703704);(189.16296,0.24924925);(189.17487,0.03303303);(189.35977,0.03303303);(190.1738,0.04104104);(191.14653,0.08908909);(191.18347,0.03303303);(201.15942,0.03303303);(203.162,0.18318318);(203.17973,1.0);(204.16859,0.03303303);(204.18903,0.16516517);(205.15956,0.65165165);(205.18228,0.04104104);(206.14626,0.04104104);(207.17064,0.03303303);(207.17993,0.07207207);(212.15439,0.03303303);(213.15996,0.04304304);(215.17091,0.09109109);(217.19707,0.05405405);(219.1703,0.03503504);(220.18404,0.04304304);(221.19659,0.03303303);(223.15852,0.03503504);(223.18367,0.03903904);(226.17552,0.03903904);(228.17442,0.04304304);(229.20395,0.07007007);(230.19783,0.04304304);(231.17632,0.03303303);(246.17958,0.06206206);(249.17978,0.03303303);(249.2188,0.03903904);(251.17195,0.03903904);(251.18979,0.04504505);(266.20551,0.03503504);(349.29056,0.05205205);(353.24899,0.03903904);(381.34937,0.03903904);(391.32959,0.04304304);(392.35092,0.04304304);(409.31702,0.03903904);(409.34586,0.07607608);(411.32523,0.04504505);(425.32608,0.03903904);(427.37396,0.03703704);(438.33597,0.03303303)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(71.07,0.077);(107.082,0.064);(121.105,0.087);(123.105,0.077);(133.105,0.151);(135.116,0.064);(137.132,0.055);(147.116,0.074);(147.121,0.058);(149.129,0.058);(161.135,0.196);(163.148,0.141);(164.155,0.077);(173.128,0.061);(175.134,0.074);(175.148,0.064);(177.165,0.145);(178.159,0.087);(185.133,0.064);(187.149,0.129);(189.163,0.103);(189.169,0.212);(191.184,0.119);(192.193,0.064);(193.161,0.116);(201.169,0.058);(203.169,0.09);(203.179,0.264);(203.19,0.103);(204.181,0.077);(204.191,0.071);(205.154,0.061);(205.167,0.119);(205.197,0.116);(206.154,0.064);(207.173,0.196);(207.186,0.119);(208.181,0.132);(216.179,0.068);(222.194,0.074);(231.175,0.09);(233.192,0.068);(247.16,0.055);(267.173,0.064);(324.281,0.077);(349.284,0.08);(375.467,0.071);(381.343,0.071);(391.332,0.068);(392.339,0.183);(409.331,0.19);(409.348,1.0);(409.359,0.283);(410.345,0.17);(410.361,0.299);(410.379,0.055);(411.329,0.061);(411.369,0.158);(412.349,0.093);(427.363,0.122);(437.329,0.376);(437.352,0.141);(438.345,0.058);(439.32,0.058);(439.351,0.064);(439.369,0.071);(455.337,0.116);(455.364,0.145);(473.346,0.322);(473.368,0.617)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(149.129,0.028);(163.155,0.016);(190.168,0.013);(203.178,0.022);(204.193,0.019);(205.151,0.013);(205.162,0.016);(207.172,0.092);(208.181,0.032);(220.292,0.024);(221.153,0.017);(241.165,0.017);(248.182,0.017);(317.661,0.02);(353.013,0.022);(372.588,0.016);(391.339,0.013);(409.287,0.013);(409.334,0.124);(409.351,0.352);(410.346,0.046);(410.362,0.019);(411.337,0.036);(427.388,0.014);(428.356,0.017);(429.383,0.018);(437.315,0.017);(437.337,0.032);(437.357,0.041);(438.338,0.047);(438.376,0.024);(447.206,0.014);(449.008,0.014);(455.345,0.198);(455.393,0.013);(456.332,0.018);(456.353,0.05);(473.36,1.0);(473.384,0.162)
LC-MS/MSLC-ESI-QTOFPositivemediumView Spectrum(81.064,0.04);(81.075,0.047);(95.088,0.072);(95.091,0.036);(97.089,0.04);(105.064,0.036);(105.525,0.057);(107.087,0.083);(119.085,0.091);(121.1,0.045);(133.104,0.036);(135.1,0.038);(135.109,0.045);(136.114,0.045);(142.049,0.042);(147.114,0.038);(149.124,0.049);(150.143,0.042);(151.153,0.036);(153.089,0.04);(153.099,0.036);(157.093,0.038);(159.104,0.072);(161.128,0.042);(161.137,0.085);(162.138,0.049);(163.104,0.042);(163.112,0.038);(163.119,0.045);(163.145,0.047);(163.151,0.11);(164.125,0.045);(165.12,0.036);(175.135,0.038);(175.15,0.127);(176.155,0.051);(177.124,0.042);(177.155,0.038);(177.169,0.176);(178.16,0.047);(179.14,0.042);(179.169,0.04);(187.111,0.036);(187.149,0.138);(187.213,0.087);(187.331,0.038);(189.155,0.166);(189.168,0.178);(190.16,0.047);(191.178,0.038);(191.186,0.036);(191.387,0.036);(192.179,0.053);(192.192,0.049);(201.161,0.038);(201.171,0.159);(203.138,0.045);(203.166,0.076);(203.18,1.0);(204.14,0.045);(204.179,0.17);(205.151,0.219);(205.167,0.18);(206.161,0.038);(207.173,0.121);(207.18,0.04);(208.183,0.038);(211.138,0.051);(213.171,0.102);(215.163,0.036);(219.141,0.036);(219.171,0.136);(219.204,0.042);(221.192,0.057);(227.18,0.036);(229.204,0.049);(230.2,0.047);(248.689,0.049);(249.174,0.057);(249.192,0.042);(252.196,0.04);(255.212,0.053);(266.694,0.053);(271.111,0.038);(325.282,0.038);(353.29,0.064);(367.348,0.036);(381.363,0.117);(384.369,0.049);(409.338,0.193);(409.354,0.083);(410.336,0.049);(410.351,0.079)
LC-MS/MSLC-ESI-QTOFPositivehighView Spectrum(67.052,0.121);(81.067,0.106);(93.071,0.232);(95.078,0.101);(105.066,0.283);(105.073,0.172);(106.08,0.096);(107.081,0.308);(107.089,0.232);(109.105,0.101);(119.087,0.545);(121.101,0.086);(121.109,0.101);(122.093,0.136);(125.101,0.167);(133.096,0.273);(133.115,0.086);(134.11,0.141);(135.115,0.182);(136.119,0.258);(138.139,0.126);(145.091,0.111);(145.105,0.429);(147.118,1.0);(149.084,0.136);(159.107,0.126);(161.131,0.217);(163.151,0.101);(164.081,0.106);(173.13,0.091);(174.14,0.091);(175.149,0.273);(177.13,0.086);(177.165,0.232);(189.162,0.172);(201.155,0.086);(203.186,0.086);(204.192,0.141);(205.156,0.096);(216.183,0.212)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(97.092,0.038);(107.086,0.131);(119.083,0.077);(123.12,0.038);(133.101,0.04);(133.107,0.051);(135.117,0.038);(147.112,0.073);(151.137,0.049);(160.106,0.066);(163.141,0.084);(163.151,0.055);(164.152,0.046);(171.112,0.046);(175.146,0.058);(177.158,0.046);(177.168,0.04);(189.147,0.038);(189.159,0.053);(189.17,0.119);(190.163,0.04);(191.177,0.06);(201.166,0.097);(203.17,0.153);(203.179,0.414);(203.192,0.071);(204.183,0.097);(205.161,0.29);(206.165,0.044);(207.174,0.206);(220.127,0.053);(223.168,0.04);(229.197,0.044);(235.164,0.06);(235.214,0.062);(243.216,0.049);(249.187,0.091);(259.315,0.046);(321.251,0.042);(381.372,0.055);(383.374,0.044);(389.31,0.073);(391.346,0.064);(392.331,0.053);(409.264,0.073);(409.346,1.0);(409.361,0.206);(410.334,0.084);(410.352,0.219);(411.366,0.08);(412.34,0.04);(412.363,0.122);(425.352,0.051);(427.357,0.142);(429.35,0.044);(430.342,0.04);(437.347,0.204);(438.054,0.053);(438.339,0.046);(438.359,0.044);(455.338,0.144);(455.358,0.133);(456.348,0.124);(457.358,0.055);(458.711,0.038);(473.368,0.489)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(163.276,0.018);(189.16,0.013);(189.166,0.021);(203.188,0.018);(207.177,0.054);(207.192,0.016);(229.187,0.015);(250.187,0.04);(260.189,0.012);(391.341,0.014);(394.356,0.012);(409.298,0.013);(409.319,0.019);(409.35,0.312);(410.335,0.012);(410.353,0.053);(410.368,0.047);(412.255,0.02);(412.354,0.014);(424.054,0.014);(427.342,0.016);(427.361,0.026);(428.388,0.03);(430.362,0.014);(437.308,0.018);(437.334,0.141);(438.195,0.012);(438.32,0.015);(438.349,0.108);(439.349,0.015);(455.345,0.139);(455.364,0.11);(455.554,0.016);(456.332,0.013);(456.358,0.156);(471.328,0.012);(473.297,0.021);(473.309,0.014);(473.363,1.0)
LC-MS/MSLC-ESI-QTOFPositivemediumView Spectrum(79.059,0.07);(95.084,0.074);(105.066,0.033);(107.079,0.136);(121.106,0.039);(135.12,0.12);(149.138,0.117);(154.093,0.041);(159.112,0.035);(159.119,0.054);(163.108,0.035);(163.144,0.062);(163.153,0.091);(167.116,0.033);(171.125,0.049);(173.129,0.083);(175.146,0.037);(177.156,0.041);(177.174,0.049);(178.149,0.056);(178.168,0.076);(179.142,0.033);(187.142,0.089);(187.152,0.14);(187.159,0.037);(189.163,0.249);(189.175,0.033);(189.36,0.033);(190.174,0.041);(191.147,0.089);(191.183,0.033);(201.159,0.033);(203.162,0.183);(203.18,1.0);(204.169,0.033);(204.189,0.165);(205.16,0.652);(205.182,0.041);(206.146,0.041);(207.171,0.033);(207.18,0.072);(212.154,0.033);(213.16,0.043);(215.171,0.091);(217.197,0.054);(219.17,0.035);(220.184,0.043);(221.197,0.033);(223.159,0.035);(223.184,0.039);(226.176,0.039);(228.174,0.043);(229.204,0.07);(230.198,0.043);(231.176,0.033);(246.18,0.062);(249.18,0.033);(249.219,0.039);(251.172,0.039);(251.19,0.045);(266.206,0.035);(349.291,0.052);(353.249,0.039);(381.349,0.039);(391.33,0.043);(392.351,0.043);(409.317,0.039);(409.346,0.076);(411.325,0.045);(425.326,0.039);(427.374,0.037);(438.336,0.033)
LC-MS/MSLC-ESI-QTOFPositivehighView Spectrum(69.071,0.126);(95.086,0.335);(105.068,0.621);(107.084,0.083);(108.091,0.218);(109.101,0.092);(117.069,0.102);(119.086,1.0);(121.104,0.16);(122.107,0.223);(131.086,0.092);(133.099,0.262);(133.108,0.083);(135.039,0.097);(141.073,0.136);(145.091,0.083);(145.103,0.558);(145.113,0.107);(147.119,0.544);(148.084,0.092);(150.128,0.087);(158.114,0.083);(159.117,0.189);(161.136,0.393);(165.127,0.107);(177.123,0.083);(177.168,0.282);(187.144,0.194);(189.166,0.199);(201.163,0.175);(203.175,0.17);(203.186,0.087);(213.158,0.214)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(67.045,0.078);(77.755,0.059);(93.07,0.07);(107.087,0.075);(109.106,0.084);(119.088,0.123);(121.106,0.056);(135.122,0.073);(147.11,0.101);(147.119,0.201);(163.11,0.047);(163.155,0.089);(167.133,0.056);(175.15,0.196);(177.165,0.126);(187.15,0.128);(189.152,0.162);(189.165,0.137);(189.176,0.056);(190.163,0.07);(192.185,0.061);(193.123,0.056);(193.188,0.061);(201.16,0.179);(202.176,0.05);(202.786,0.056);(203.182,0.693);(204.188,0.059);(205.164,0.103);(207.156,0.067);(207.176,0.302);(208.184,0.053);(219.185,0.103);(221.189,0.064);(229.201,0.067);(231.172,0.067);(231.203,0.07);(232.221,0.087);(233.186,0.056);(235.174,0.07);(241.203,0.056);(247.164,0.059);(249.175,0.056);(249.185,0.061);(271.23,0.047);(293.21,0.061);(295.251,0.07);(329.125,0.056);(409.326,0.103);(409.348,1.0);(409.374,0.056);(410.354,0.251);(411.361,0.064);(427.351,0.053);(427.364,0.078);(429.367,0.061);(437.332,0.145);(437.349,0.142);(438.357,0.056);(439.304,0.056);(455.336,0.128);(458.378,0.047);(473.367,0.358)
LC-MS/MSLC-ESI-QTOFPositivelowView Spectrum(163.138,0.023);(189.15,0.026);(189.165,0.05);(205.144,0.017);(207.179,0.161);(208.174,0.017);(208.183,0.029);(209.162,0.019);(249.181,0.022);(293.219,0.02);(314.171,0.028);(320.308,0.019);(403.783,0.019);(409.312,0.026);(409.348,0.466);(410.343,0.061);(411.36,0.019);(424.247,0.017);(427.341,0.017);(427.38,0.043);(437.293,0.019);(437.335,0.079);(437.349,0.06);(437.37,0.027);(438.355,0.019);(439.365,0.017);(455.346,0.302);(456.089,0.023);(456.364,0.03);(457.358,0.067);(473.316,0.023);(473.362,1.0)
LC-MS/MSLC-ESI-QTOFPositivemediumView Spectrum(93.071,0.043);(95.083,0.105);(98.072,0.069);(107.085,0.048);(109.102,0.061);(109.114,0.046);(119.088,0.105);(120.206,0.056);(121.084,0.056);(123.117,0.046);(129.61,0.051);(133.102,0.186);(135.081,0.064);(147.112,0.054);(147.122,0.077);(148.115,0.054);(149.134,0.107);(151.143,0.061);(161.134,0.046);(161.138,0.082);(163.122,0.061);(166.091,0.051);(169.127,0.048);(173.135,0.064);(175.147,0.097);(177.121,0.048);(177.129,0.054);(177.167,0.163);(177.175,0.089);(178.165,0.048);(181.36,0.051);(185.098,0.046);(187.149,0.061);(189.155,0.181);(189.165,0.403);(189.178,0.115);(191.178,0.054);(191.188,0.046);(201.16,0.043);(201.168,0.133);(201.282,0.069);(202.168,0.048);(203.004,0.056);(203.178,1.0);(204.163,0.043);(204.186,0.051);(205.158,0.329);(205.19,0.061);(207.18,0.051);(213.165,0.061);(217.195,0.046);(218.207,0.051);(219.184,0.056);(219.208,0.046);(245.191,0.051);(249.147,0.074);(261.222,0.054);(321.261,0.074);(321.278,0.043);(339.261,0.054);(367.305,0.059);(391.327,0.043);(391.346,0.051);(409.348,0.105);(410.339,0.046);(427.365,0.051);(427.383,0.066);(428.373,0.043);(437.346,0.097)
LC-MS/MSLC-ESI-QTOFPositivehighView Spectrum(81.07,0.138);(84.087,0.113);(94.072,0.138);(95.084,0.805);(105.068,0.107);(105.074,0.56);(106.077,0.22);(107.086,0.296);(108.091,0.107);(111.12,0.126);(119.081,0.239);(119.087,1.0);(121.102,0.673);(131.078,0.151);(133.101,0.579);(133.107,0.34);(134.103,0.113);(135.113,0.447);(137.101,0.126);(145.101,0.509);(147.122,0.126);(149.064,0.107);(149.129,0.151);(149.139,0.138);(154.331,0.258);(159.114,0.145);(161.116,0.201);(161.136,0.151);(163.108,0.138);(163.153,0.327);(169.104,0.176);(171.117,0.132);(173.131,0.289);(173.137,0.119);(174.146,0.107);(175.141,0.289);(176.155,0.132);(177.156,0.107);(178.17,0.119);(186.141,0.113);(187.149,0.289);(189.162,0.107);(201.16,0.126);(205.16,0.107);(206.169,0.189);(231.182,0.107)

Food Sources

NameGroup
AppleFruit, Pomes PublicationsShow
Olive oilFats and oils PublicationsShow

Food Sources of its Food Phytochemical(s)

Food PhytochemicalFood SourceFood Source Group
Maslinic acidAppleFruit, Pomes PublicationsShow
Maslinic acidOlive oilFats and oils PublicationsShow

Role as Biomarker of intake

No roles as Biomarker of intake found

Metabolism

Food PhytochemicalMetaboliteSpeciesBiofluidsOriginTMaxCMaxUrinary ExcretionFormulaMonoisotopic mass
Maslinic acid Maslinic acidhumanplasmaunchanged3h-5h<20 nmol/LNot AvailableC30H48O4472.355260026 Detailed Intervention Studies Publications

Inter-Individual Variations in Metabolism

Food PhytochemicalMetaboliteEffectValue
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