PhytoHub: Showing entry for Quercetin 3-O-galactoside

Quercetin 3-O-galactoside

Identification

PhytoHub ID

PHUB000660

Name

Quercetin 3-O-galactoside

Systematic Name

Not Available

Synonyms

Hyperin
Hyperoside

CAS Number

Not Available

Average Mass

464.379

Monoisotopic Mass

464.095476084

Chemical Formula

C₂₁H₂₀O₁₂

IUPAC Name

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one

InChI Key

OVSQVDMCBVZWGM-DTGCRPNFSA-N

InChI Identifier

InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1

SMILES

OC[C@H]1O[C@@H](OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)[C@H](O)[C@@H](O)[C@H]1O

Structure

Similar Structures

Calculated Properties

Solubility (ALOGPS): 1.95e+00 g/l
LogS (ALOGPS): -2.38
LogP (ALOGPS): 0.47
Hydrogen Acceptors: 12
Hydrogen Donors: 8
Rotatable Bond Count: 4
Polar Surface Area: 206.59999999999997
Refractivity: 109.27549999999997
Polarizability: 43.38686097735078
Formal Charge: 0
Physiological Charge: -1
pKa (strongest basic): -2.98109237118166
pKa (strongest acidic): 6.372405531686565
Number of Rings: 4
Rule of Five: No
Bioavailability: No
Ghose Filter: Yes
Veber's Rule: No
MDDR-like Rule: No

External Links

ChEBI: 68352
ChEBI: 67486
PubChem: 5281643
MetaboLights: MTBLC67486
Phenol-Explorer: 292
FooDB (Compounds): FDB002711

Taxonomy as Food Phytochemical

Family: Polyphenols
Class: Flavonoids
Sub-class: Flavonols

Taxonomy as Metabolite

Metabolite Family: Not Available
Metabolite Class: Not Available
Metabolite Sub-class: Not Available

Taxonomy of its Food Phytochemical Precursor(s)

Food Phytochemical	Family	Class	Sub-class
Cranberry flavonols	Polyphenols	Flavonoids	Flavonols	Show Food Phytochemical

Spectra from Phytohub

Spectrum Type	Instrument Type	Ion Mode	Collision Energy Level	View	Peaks

LC-MS/MS	LC-ESI-QTOF	Positive	medium	View Spectrum	(91.0389,0.01501502);(303.0499,1.0);(304.0532,0.13913914);(305.0553,0.02002002)
LC-MS/MS	LC-ESI-QTOF	Negative	medium	View Spectrum	(300.0277,0.11411411);(301.0348,0.11211211);(302.039,0.01501502);(463.0883,1.0);(464.0918,0.22022022);(465.094,0.05305305)
LC-MS/MS	LC-ESI-QTOF	Positive	high	View Spectrum	(91.0391,0.01001001);(97.0283,0.01101101);(137.0234,0.01701702);(153.0183,0.03103103);(165.0181,0.02202202);(229.0493,0.03203203);(247.0597,0.01301301);(257.0444,0.03103103);(285.0394,0.02002002);(303.05,1.0);(304.0533,0.13513514);(305.0553,0.02102102)
LC-MS/MS	LC-ESI-QTOF	Negative	medium	View Spectrum	(300.0279,1.0);(301.0345,0.48648649);(302.0379,0.06906907);(303.0397,0.01201201);(463.0882,0.34234234);(464.0915,0.07607608);(465.0944,0.01501502)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(303.0502,1.0);(304.0534,0.14014014);(305.0555,0.02302302);(465.1033,0.35635636);(466.1064,0.07707708);(467.1086,0.01601602)
LC-MS/MS	LC-ESI-QTOF	Positive	high	View Spectrum	(91.0389,0.01201201);(303.0499,1.0);(304.0532,0.13213213);(305.0552,0.01901902)
LC-MS/MS	LC-ESI-QTOF	Negative	high	View Spectrum	(151.0038,0.01801802);(178.999,0.02002002);(243.0297,0.01201201);(255.0303,0.05505506);(271.025,0.10510511);(272.0308,0.02602603);(300.0281,1.0);(301.034,0.31731732);(302.0368,0.04704705);(463.0897,0.01001001)
LC-MS/MS	LC-ESI-QTOF	Negative	low	View Spectrum	(463.0886,1.0);(464.0924,0.23723724);(465.0939,0.04904905)
LC-MS/MS	LC-ESI-QTOF	Negative	high	View Spectrum	(148.0163,0.01301301);(151.0036,0.07407407);(163.0033,0.02402402);(164.0107,0.01001001);(178.9985,0.02902903);(216.0424,0.01101101);(226.0267,0.01201201);(227.0347,0.02002002);(243.0301,0.13513514);(244.0358,0.02102102);(245.0457,0.02902903);(254.0226,0.03803804);(255.0302,0.31131131);(256.0336,0.05205205);(271.0252,0.72472472);(272.0298,0.12512513);(273.038,0.02802803);(283.0256,0.02002002);(299.0202,0.01601602);(300.028,1.0);(301.0332,0.24524525);(302.0363,0.03703704)
LC-MS/MS	LC-ESI-QTOF	Positive	medium	View Spectrum	(91.0386,0.01201201);(145.0497,0.01701702);(303.0499,1.0);(304.0533,0.14614615);(305.0554,0.02102102)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(85.03246,0.03003003);(97.02724,0.00700701);(98.0295,0.00900901);(127.04238,0.00800801);(127.05202,0.00600601);(137.01434,0.03203203);(138.02225,0.00700701);(165.01381,0.02502503);(165.02167,0.00600601);(177.15021,0.01301301);(183.05507,0.01501502);(216.5726,0.00900901);(231.07178,0.00700701);(285.01031,0.00900901);(285.02097,0.00900901);(302.98083,0.00700701);(303.00583,0.02102102);(303.04782,1.0);(303.08521,0.00600601);(303.66504,0.00700701);(304.03851,0.07107107);(304.06061,0.06906907);(304.76859,0.01001001);(305.04691,0.03303303);(305.05856,0.04904905);(306.64081,0.00700701);(369.06976,0.00700701);(370.0571,0.00600601);(381.04837,0.00900901);(381.07101,0.01001001);(392.06161,0.01201201);(465.07175,0.01101101);(465.0954,0.04604605);(465.12311,0.02002002)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(85.02037,0.01101101);(91.03162,0.01801802);(145.04858,0.00700701);(301.46634,0.00600601);(303.01108,0.00700701);(303.04971,1.0);(304.02005,0.01001001);(304.03848,0.01901902);(304.05032,0.05805806);(304.06152,0.05405405);(305.00552,0.00700701);(305.04721,0.00900901);(305.05908,0.00800801);(306.03802,0.00900901);(314.44479,0.00600601);(427.96408,0.00800801);(430.10437,0.00600601);(465.06686,0.02002002);(465.08994,0.0960961);(465.10959,0.25025025)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(61.03151,0.01401401);(77.11903,0.00600601);(85.02277,0.00800801);(85.0331,0.01101101);(97.02612,0.00700701);(99.03339,0.01001001);(100.05267,0.00800801);(101.02143,0.01001001);(117.04105,0.00700701);(132.282,0.00600601);(219.02394,0.01001001);(229.0556,0.00800801);(247.06604,0.00700701);(257.05066,0.01301301);(285.03351,0.00600601);(302.04147,0.00600601);(302.87329,0.00700701);(302.97498,0.01001001);(303.01096,0.00700701);(303.04929,1.0);(303.42813,0.00600601);(303.99948,0.00700701);(304.01019,0.01201201);(304.04398,0.05205205);(304.05679,0.03303303);(305.05072,0.01201201);(305.06287,0.00600601);(327.05109,0.00800801);(369.03793,0.00800801);(388.95618,0.01001001)
LC-MS/MS	LC-ESI-QTOF	Negative	high	View Spectrum	(151.005,0.11211211);(179.0,0.05605606);(227.0372,0.06306306);(243.0327,0.18218218);(255.0325,0.32632633);(271.0274,0.6966967);(300.0293,1.0);(301.039,0.44944945);(463.0877,0.78078078)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(61.01892,0.00700701);(61.02967,0.00700701);(91.03951,0.01001001);(97.03306,0.00700701);(115.04126,0.01001001);(145.06396,0.00900901);(163.05551,0.00700701);(165.01666,0.03103103);(188.04709,0.00800801);(208.84021,0.00900901);(229.03587,0.00900901);(229.05396,0.00700701);(247.05324,0.00900901);(257.04401,0.01401401);(299.05432,0.01301301);(302.98209,0.01401401);(303.01233,0.00800801);(303.04947,1.0);(303.09396,0.00700701);(304.01724,0.01701702);(304.04584,0.06706707);(304.05481,0.15715716);(305.03946,0.01901902);(305.06247,0.03503504);(307.06796,0.00800801);(316.05072,0.01001001);(393.06717,0.01601602);(432.98209,0.00700701);(448.0809,0.00900901);(465.09692,0.02902903);(465.11322,0.00900901)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(61.02864,0.01201201);(85.02852,0.01001001);(91.04053,0.00600601);(99.04797,0.01701702);(110.97621,0.00700701);(111.00613,0.01001001);(115.03711,0.00800801);(118.43075,0.01101101);(121.02892,0.01501502);(127.02678,0.01301301);(135.82083,0.00700701);(149.02831,0.00600601);(165.01776,0.00700701);(191.06554,0.02102102);(201.05453,0.01101101);(213.0529,0.00900901);(219.06,0.00800801);(228.04489,0.00900901);(247.06473,0.01001001);(302.99371,0.00700701);(303.00629,0.01301301);(303.01733,0.01201201);(303.05032,1.0);(303.12592,0.00600601);(304.04684,0.18018018);(304.06268,0.06106106);(305.03784,0.01701702);(305.05817,0.02302302);(305.07037,0.01001001);(307.44815,0.00600601);(309.07199,0.00600601);(315.04147,0.00800801);(343.06079,0.00700701);(365.05853,0.00700701)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(61.02826,0.02902903);(61.89494,0.00800801);(81.0359,0.00800801);(85.02435,0.00900901);(91.03984,0.05205205);(115.03752,0.02002002);(137.01514,0.01001001);(145.05711,0.00700701);(165.01715,0.00800801);(201.05331,0.01001001);(229.04274,0.01101101);(241.01923,0.01101101);(257.04089,0.00800801);(275.04843,0.00800801);(301.05243,0.00800801);(303.01465,0.00900901);(303.05161,1.0);(303.09103,0.01201201);(304.00192,0.00900901);(304.03662,0.01301301);(304.05347,0.13013013);(305.04138,0.00800801);(305.05542,0.00800801);(369.11673,0.01801802)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(85.01256,0.00600601);(86.03078,0.00700701);(115.03919,0.01101101);(117.05388,0.01201201);(145.05775,0.00800801);(149.02472,0.00700701);(157.06531,0.01401401);(163.0414,0.01401401);(163.06201,0.00800801);(165.01799,0.00600601);(187.04271,0.00600601);(193.69341,0.00900901);(201.05675,0.00700701);(229.04727,0.01501502);(229.05765,0.02302302);(229.28415,0.00600601);(257.04816,0.00700701);(274.03506,0.00800801);(275.0571,0.00600601);(285.04828,0.01001001);(302.97177,0.00600601);(302.9884,0.01101101);(303.00211,0.00800801);(303.02173,0.01501502);(303.05078,1.0);(303.08896,0.00800801);(303.74686,0.01101101);(303.99524,0.00800801);(304.02338,0.00700701);(304.04767,0.1011011);(304.06519,0.03803804);(304.91928,0.00600601);(305.05988,0.03303303);(308.9928,0.00600601);(315.0408,0.02002002);(321.03864,0.00700701);(369.02563,0.00700701);(406.97769,0.00900901);(465.04761,0.00800801);(465.10812,0.04804805)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(91.0401,0.00800801);(300.61386,0.01201201);(302.30759,0.00700701);(302.99731,0.00800801);(303.01706,0.01001001);(303.04761,1.0);(304.05179,0.13313313);(304.06595,0.02102102);(305.06119,0.01501502);(306.05814,0.00700701);(315.02603,0.00700701);(399.05145,0.01001001);(411.06863,0.00500501);(427.96005,0.01101101);(465.01202,0.01201201);(465.04376,0.02102102);(465.06915,0.01301301);(465.10199,0.35035035);(465.18234,0.00600601)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(69.03182,0.13513514);(72.58186,0.12712713);(85.0295,0.15215215);(109.02981,0.18018018);(109.85114,0.08208208);(111.00915,0.13113113);(117.06889,0.08208208);(133.02553,0.07007007);(137.01216,0.07407407);(137.02098,0.1021021);(137.03093,0.21721722);(153.00233,0.13513514);(153.01802,1.0);(154.01918,0.28328328);(165.00908,0.27927928);(165.01787,0.13513514);(166.0228,0.09409409);(169.52667,0.13113113);(179.02867,0.08608609);(181.02942,0.14814815);(183.03751,0.09409409);(187.0415,0.1021021);(191.07211,0.14814815);(201.05672,0.42242242);(202.05125,0.16416416);(203.17165,0.09009009);(204.04164,0.09009009);(211.03651,0.20920921);(229.04355,0.31131131);(229.05453,0.07407407);(232.04224,0.13513514);(245.0446,0.10710711);(246.50652,0.11911912);(257.04431,0.32832833);(257.05807,0.29129129);(267.01648,0.11511512);(275.07172,0.08208208);(281.47278,0.13513514);(286.68732,0.11511512);(303.05197,0.51151151);(304.04849,0.17217217);(314.07538,0.07007007);(410.49683,0.08608609)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(63.02434,0.08508509);(115.05238,0.09009009);(131.04781,0.14214214);(134.02682,0.08508509);(137.01598,0.13213213);(137.02274,0.09009009);(138.02225,0.11311311);(143.05597,0.08508509);(153.01729,0.86286286);(163.03416,0.11311311);(165.02101,0.33033033);(173.06039,0.15115115);(177.01933,0.16516517);(183.03702,0.11311311);(187.04922,0.13713714);(194.01724,0.12712713);(217.05142,0.0990991);(229.04852,1.0);(230.04964,0.09009009);(230.05855,0.12312312);(231.05103,0.16516517);(245.01825,0.13213213);(256.0423,0.12312312);(257.04898,0.34034034);(274.03854,0.08008008);(274.05899,0.08008008);(285.03708,0.12312312);(303.04242,0.12312312);(303.06348,0.09009009);(305.07126,0.13713714);(327.96176,0.0990991)
LC-MS/MS	LC-ESI-QTOF	Positive	high	View Spectrum	(61.0298,0.01601602);(73.0299,0.01201201);(85.0297,0.04704705);(91.0399,0.03103103);(97.0295,0.02402402);(121.0306,0.01101101);(127.0422,0.01101101);(137.0249,0.03903904);(153.02,0.05105105);(165.0196,0.02702703);(201.0563,0.02002002);(229.0497,0.04704705);(257.0452,0.03303303);(285.0424,0.01401401);(303.0502,1.0);(304.0563,0.01501502);(465.1033,0.02002002)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(91.03899,0.01101101);(127.03545,0.00700701);(145.04716,0.00900901);(303.01248,0.01501502);(303.04913,1.0);(303.98709,0.01001001);(304.03561,0.02002002);(304.05194,0.16816817);(304.07748,0.01901902);(305.03714,0.00700701);(305.06165,0.00800801);(324.4194,0.00700701);(465.06104,0.00800801);(465.10587,0.32132132)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(64.13017,0.14014014);(77.03941,0.12412412);(91.03439,0.2042042);(97.02929,0.17717718);(109.02502,0.14014014);(111.00611,0.22022022);(118.07546,0.14014014);(121.02295,0.26326326);(129.05534,0.10810811);(137.02078,0.26326326);(137.03212,0.32832833);(147.02034,0.15615616);(150.02153,0.10810811);(153.02016,0.73673674);(159.04652,0.14014014);(162.0285,0.12912913);(165.01462,0.18318318);(165.0311,0.10810811);(166.44267,0.10810811);(167.02278,0.10810811);(173.05594,0.24724725);(179.04491,0.21021021);(184.04016,0.17217217);(184.05827,0.16116116);(187.03835,0.16716717);(201.02197,0.09109109);(201.0611,0.48448448);(202.05948,0.24224224);(217.04898,0.18818819);(219.03412,0.17217217);(219.06856,0.0970971);(228.03394,0.0970971);(229.047,1.0);(229.05652,0.31231231);(241.03348,0.12912913);(245.03687,0.15115115);(247.07515,0.17217217);(257.05298,0.10810811);(274.04819,0.11811812);(285.02097,0.10810811);(286.87741,0.14014014);(303.04227,0.36636637);(303.05347,0.88188188);(305.05063,0.33933934);(306.0687,0.0970971)
LC-MS/MS	LC-ESI-QTOF	Negative	high	View Spectrum	(151.0047,0.11611612);(178.9994,0.05805806);(227.0367,0.06506507);(243.0319,0.17517518);(255.032,0.34934935);(271.0266,0.69469469);(272.0327,0.07107107);(300.0288,1.0);(301.0383,0.51351351);(463.0876,0.81681682);(464.0979,0.08708709)
LC-MS/MS	LC-ESI-QTOF	Positive	high	View Spectrum	(85.0294,0.05205205);(91.0399,0.03003003);(97.029,0.02602603);(137.0233,0.03703704);(153.0185,0.04704705);(165.0181,0.03003003);(201.0545,0.02102102);(229.0497,0.05205205);(257.0439,0.03203203);(303.0483,1.0);(304.0546,0.03203203);(465.1033,0.02802803)
LC-MS/MS	LC-ESI-QTOF	Positive	high	View Spectrum	(61.03,0.016);(73.03,0.012);(85.03,0.047);(91.04,0.031);(97.03,0.024);(121.031,0.011);(127.042,0.011);(137.025,0.039);(153.02,0.051);(165.02,0.027);(201.056,0.02);(229.05,0.047);(257.045,0.033);(285.042,0.014);(303.05,1.0);(304.056,0.015);(465.103,0.02)
LC-MS/MS	LC-ESI-QTOF	Negative	high	View Spectrum	(151.005,0.112);(179.0,0.056);(227.037,0.063);(243.033,0.182);(255.032,0.327);(271.027,0.697);(300.029,1.0);(301.039,0.449);(463.088,0.781)
LC-MS/MS	LC-ESI-QTOF	Negative	high	View Spectrum	(151.005,0.116);(178.999,0.058);(227.037,0.065);(243.032,0.175);(255.032,0.349);(271.027,0.695);(272.033,0.071);(300.029,1.0);(301.038,0.513);(463.088,0.817);(464.098,0.087)
LC-MS/MS	LC-ESI-QTOF	Positive	high	View Spectrum	(85.029,0.052);(91.04,0.03);(97.029,0.026);(137.023,0.037);(153.018,0.047);(165.018,0.03);(201.054,0.021);(229.05,0.052);(257.044,0.032);(303.048,1.0);(304.055,0.032);(465.103,0.028)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(91.04,0.01);(115.041,0.01);(165.017,0.031);(257.044,0.014);(299.054,0.013);(302.982,0.014);(303.049,1.0);(304.017,0.017);(304.046,0.067);(304.055,0.157);(305.039,0.019);(305.062,0.035);(316.051,0.01);(393.067,0.016);(465.097,0.029)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(85.02,0.011);(91.032,0.018);(303.05,1.0);(304.02,0.01);(304.038,0.019);(304.05,0.058);(304.062,0.054);(465.067,0.02);(465.09,0.096);(465.11,0.25)
LC-MS/MS	LC-ESI-QTOF	Positive	medium	View Spectrum	(61.028,0.029);(91.04,0.052);(115.038,0.02);(137.015,0.01);(201.053,0.01);(229.043,0.011);(241.019,0.011);(303.052,1.0);(303.091,0.012);(304.037,0.013);(304.053,0.13);(369.117,0.018)
LC-MS/MS	LC-ESI-QTOF	Positive	high	View Spectrum	(64.13,0.14);(77.039,0.124);(91.034,0.204);(97.029,0.177);(109.025,0.14);(111.006,0.22);(118.075,0.14);(121.023,0.263);(129.055,0.108);(137.021,0.263);(137.032,0.328);(147.02,0.156);(150.022,0.108);(153.02,0.737);(159.047,0.14);(162.028,0.129);(165.015,0.183);(165.031,0.108);(166.443,0.108);(167.023,0.108);(173.056,0.247);(179.045,0.21);(184.04,0.172);(184.058,0.161);(187.038,0.167);(201.022,0.091);(201.061,0.484);(202.059,0.242);(217.049,0.188);(219.034,0.172);(219.069,0.097);(228.034,0.097);(229.047,1.0);(229.057,0.312);(241.033,0.129);(245.037,0.151);(247.075,0.172);(257.053,0.108);(274.048,0.118);(285.021,0.108);(286.877,0.14);(303.042,0.366);(303.053,0.882);(305.051,0.339);(306.069,0.097)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(85.032,0.03);(137.014,0.032);(165.014,0.025);(177.15,0.013);(183.055,0.015);(303.006,0.021);(303.048,1.0);(304.039,0.071);(304.061,0.069);(304.769,0.01);(305.047,0.033);(305.059,0.049);(381.071,0.01);(392.062,0.012);(465.072,0.011);(465.095,0.046);(465.123,0.02)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(91.039,0.011);(303.012,0.015);(303.049,1.0);(303.987,0.01);(304.036,0.02);(304.052,0.168);(304.077,0.019);(465.106,0.321)
LC-MS/MS	LC-ESI-QTOF	Positive	medium	View Spectrum	(61.029,0.012);(85.029,0.01);(99.048,0.017);(111.006,0.01);(118.431,0.011);(121.029,0.015);(127.027,0.013);(191.066,0.021);(201.055,0.011);(247.065,0.01);(303.006,0.013);(303.017,0.012);(303.05,1.0);(304.047,0.18);(304.063,0.061);(305.038,0.017);(305.058,0.023);(305.07,0.01)
LC-MS/MS	LC-ESI-QTOF	Positive	high	View Spectrum	(63.024,0.085);(115.052,0.09);(131.048,0.142);(134.027,0.085);(137.016,0.132);(137.023,0.09);(138.022,0.113);(143.056,0.085);(153.017,0.863);(163.034,0.113);(165.021,0.33);(173.06,0.151);(177.019,0.165);(183.037,0.113);(187.049,0.137);(194.017,0.127);(217.051,0.099);(229.049,1.0);(230.05,0.09);(230.059,0.123);(231.051,0.165);(245.018,0.132);(256.042,0.123);(257.049,0.34);(274.039,0.08);(274.059,0.08);(285.037,0.123);(303.042,0.123);(303.063,0.09);(305.071,0.137);(327.962,0.099)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(115.039,0.011);(117.054,0.012);(157.065,0.014);(163.041,0.014);(229.047,0.015);(229.058,0.023);(285.048,0.01);(302.988,0.011);(303.022,0.015);(303.051,1.0);(303.747,0.011);(304.048,0.101);(304.065,0.038);(305.06,0.033);(315.041,0.02);(465.108,0.048)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(300.614,0.012);(303.017,0.01);(303.048,1.0);(304.052,0.133);(304.066,0.021);(305.061,0.015);(399.051,0.01);(427.96,0.011);(465.012,0.012);(465.044,0.021);(465.069,0.013);(465.102,0.35)
LC-MS/MS	LC-ESI-QTOF	Positive	medium	View Spectrum	(61.032,0.014);(85.033,0.011);(99.033,0.01);(101.021,0.01);(219.024,0.01);(257.051,0.013);(302.975,0.01);(303.049,1.0);(304.01,0.012);(304.044,0.052);(304.057,0.033);(305.051,0.012);(388.956,0.01)
LC-MS/MS	LC-ESI-QTOF	Positive	high	View Spectrum	(69.032,0.135);(72.582,0.127);(85.03,0.152);(109.03,0.18);(109.851,0.082);(111.009,0.131);(117.069,0.082);(133.026,0.07);(137.012,0.074);(137.021,0.102);(137.031,0.217);(153.002,0.135);(153.018,1.0);(154.019,0.283);(165.009,0.279);(165.018,0.135);(166.023,0.094);(169.527,0.131);(179.029,0.086);(181.029,0.148);(183.038,0.094);(187.042,0.102);(191.072,0.148);(201.057,0.422);(202.051,0.164);(203.172,0.09);(204.042,0.09);(211.037,0.209);(229.044,0.311);(229.055,0.074);(232.042,0.135);(245.045,0.107);(246.507,0.119);(257.044,0.328);(257.058,0.291);(267.016,0.115);(275.072,0.082);(281.473,0.135);(286.687,0.115);(303.052,0.512);(304.048,0.172);(314.075,0.07);(410.497,0.086)
LC-MS/MS	LC-ESI-QTOF	Positive	low	View Spectrum	(303.05,1.0);(304.053,0.14);(305.056,0.023);(465.103,0.356);(466.106,0.077);(467.109,0.016)
LC-MS/MS	LC-ESI-QTOF	Positive	medium	View Spectrum	(91.039,0.012);(145.05,0.017);(303.05,1.0);(304.053,0.146);(305.055,0.021)
LC-MS/MS	LC-ESI-QTOF	Positive	medium	View Spectrum	(91.039,0.015);(303.05,1.0);(304.053,0.14);(305.055,0.02)
LC-MS/MS	LC-ESI-QTOF	Positive	high	View Spectrum	(91.039,0.012);(303.05,1.0);(304.053,0.132);(305.055,0.019)
LC-MS/MS	LC-ESI-QTOF	Negative	low	View Spectrum	(463.089,1.0);(464.092,0.237);(465.094,0.049)
LC-MS/MS	LC-ESI-QTOF	Negative	medium	View Spectrum	(300.028,0.115);(301.035,0.112);(302.039,0.015);(463.088,1.0);(464.092,0.22);(465.094,0.053)
LC-MS/MS	LC-ESI-QTOF	Negative	medium	View Spectrum	(300.028,1.0);(301.034,0.487);(302.038,0.069);(303.04,0.012);(463.088,0.343);(464.092,0.076);(465.094,0.015)
LC-MS/MS	LC-ESI-QTOF	Negative	high	View Spectrum	(151.004,0.018);(178.999,0.02);(243.03,0.012);(255.03,0.055);(271.025,0.105);(272.031,0.026);(300.028,1.0);(301.034,0.317);(302.037,0.047);(463.09,0.01)
LC-MS/MS	LC-ESI-QTOF	Positive	high	View Spectrum	(91.039,0.01);(97.028,0.011);(137.023,0.017);(153.018,0.031);(165.018,0.022);(229.049,0.032);(247.06,0.013);(257.044,0.031);(285.039,0.02);(303.05,1.0);(304.053,0.135);(305.055,0.021)
LC-MS/MS	LC-ESI-QTOF	Negative	high	View Spectrum	(148.016,0.013);(151.004,0.074);(163.003,0.024);(164.011,0.01);(178.998,0.029);(216.042,0.011);(226.027,0.012);(227.035,0.02);(243.03,0.136);(244.036,0.021);(245.046,0.029);(254.023,0.039);(255.03,0.311);(256.034,0.052);(271.025,0.724);(272.03,0.125);(273.038,0.028);(283.026,0.02);(299.02,0.016);(300.028,1.0);(301.033,0.246);(302.036,0.037)
LC-MS/MS	ESI- LC-Q-TOF/MS	Positive	low	View Spectrum	(69.0349,0.015);(81.0344,0.011);(85.029,0.069);(97.0299,0.024);(109.0299,0.016);(111.0091,0.01);(127.0411,0.019);(137.0242,0.035);(145.0529,0.017);(153.019,0.048);(165.0192,0.028);(201.0566,0.02);(229.0503,0.048);(257.0444,0.031);(285.0385,0.012);(303.0491,0.999);(304.0519,0.015);(465.1033,0.014)
LC-MS/MS	ESI- LC-Q-TOF/MS	Negative	low	View Spectrum	(151.0047,0.116);(178.9994,0.057);(227.0367,0.065);(243.0319,0.175);(255.032,0.348);(271.0266,0.694);(272.0327,0.071);(300.0288,0.999);(301.0383,0.512);(463.0876,0.815);(464.0979,0.087)

Food Sources

Name	Group
Almond	Nuts	Publications	Show
American cranberry	Fruit, Berries	Publications	Show
Apple	Fruit, Pomes	Publications	Show
Apple juice	Beverages, Non-alcoholic	Publications	Show
Black tea	Teas and herbal teas	Publications	Show
Blackberry	Fruit, Berries	Publications	Show
Green tea	Teas and herbal teas	Publications	Show
Mango	Fruit, Tropical fruits	Publications	Show

Food Sources of its Food Phytochemical(s)

No food source information available of its precursor(s)

Role as Biomarker of intake

No roles as Biomarker of intake found

Metabolism

	Food Phytochemical		Metabolite	Species	Biofluids	Origin	TMax	CMax	Urinary Excretion	Formula	Monoisotopic mass
	Cranberry flavonols		Quercetin 3-O-galactoside	human	urine	unknown	3h-5h	Not Available	Not Available	C₂₁H₂₀O₁₂	464.095476084		Publications

Inter-Individual Variations in Metabolism

	Food Phytochemical		Metabolite	Effect	Value

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Showing entry for Quercetin 3-O-galactoside