PhytoHub: Showing entry for (−)-Gallocatechin

(−)-Gallocatechin

Identification

PhytoHub ID

PHUB002189

Name

(−)-Gallocatechin

Systematic Name

(−)-Gallocatechin

Synonyms

Not Available

CAS Number

Not Available

Average Mass

306.27

Monoisotopic Mass

306.073952791

Chemical Formula

C₁₅H₁₄O₇

IUPAC Name

Not Available

InChI Key

XMOCLSLCDHWDHP-DOMZBBRYSA-N

InChI Identifier

InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2/t12-,15+/m1/s1

SMILES

O[C@@H]1CC2=C(O[C@H]1C1=CC(O)=C(O)C(O)=C1)C=C(O)C=C2O

Structure

Similar Structures

Calculated Properties

Solubility (ALOGPS): Not Available
LogS (ALOGPS): Not Available
LogP (ALOGPS): Not Available
Hydrogen Acceptors: Not Available
Hydrogen Donors: Not Available
Rotatable Bond Count: Not Available
Polar Surface Area: Not Available
Refractivity: Not Available
Polarizability: Not Available
Formal Charge: Not Available
Physiological Charge: Not Available
pKa (strongest basic): Not Available
pKa (strongest acidic): Not Available
Number of Rings: Not Available
Rule of Five: No
Bioavailability: No
Ghose Filter: No
Veber's Rule: No
MDDR-like Rule: No

External Links

No external links

Taxonomy as Food Phytochemical

Family: Polyphenols
Class: Flavonoids
Sub-class: Flavan-3-ols

Taxonomy as Metabolite

Metabolite Family: (Poly)phenol metabolites
Metabolite Class: Flavonoid metabolites
Metabolite Sub-class: Flavan-3-ols (parent and host metabolites)

Taxonomy of its Food Phytochemical Precursor(s)

Food Phytochemical	Family	Class	Sub-class
(−)-Gallocatechin	Polyphenols	Flavonoids	Flavan-3-ols	Show Food Phytochemical

Spectra from Phytohub

Spectrum Type	Instrument Type	Ion Mode	Collision Energy Level	View	Peaks

LC-MS/MS	ESI-TOF	Negative	Not Available	View Spectrum	(107.0506,24.0);(108.0224,24.0);(109.0298,660.0);(110.0347,84.0);(111.0456,72.0);(115.0544,14.0);(117.0346,24.0);(119.0504,35.0);(120.0236,12.0);(121.0298,165.0);(121.0654,27.0);(122.0355,28.0);(123.0082,199.0);(123.0458,29.0);(124.0166,243.0);(125.0247,999.0);(126.0285,95.0);(130.0435,17.0);(131.0505,31.0);(132.0551,11.0);(133.0293,42.0);(133.0665,25.0);(134.0372,11.0);(135.0074,12.0);(135.0456,32.0);(137.0247,874.0);(137.0619,10.0);(138.0314,234.0);(139.0401,480.0);(139.0604,10.0);(140.0465,45.0);(143.0497,21.0);(145.0293,50.0);(145.0653,20.0);(146.0386,22.0);(147.0443,45.0);(148.0534,15.0);(149.0245,73.0);(149.0602,36.0);(150.0313,37.0);(151.0397,91.0);(152.0427,19.0);(153.019,39.0);(155.0341,15.0);(157.0648,19.0);(158.0371,23.0);(159.0443,59.0);(160.0509,18.0);(161.0245,97.0);(161.0608,20.0);(162.031,24.0);(163.0402,27.0);(163.0773,14.0);(164.0109,114.0);(164.0475,23.0);(165.0192,136.0);(165.0539,18.0);(166.0267,55.0);(167.0354,156.0);(168.0389,20.0);(170.0306,11.0);(171.0469,13.0);(172.0512,23.0);(173.0246,22.0);(173.0604,34.0);(174.0341,22.0);(175.0407,86.0);(176.0452,36.0);(177.0181,46.0);(177.0554,44.0);(178.025,29.0);(179.0354,16.0);(186.0316,14.0);(187.0393,40.0);(188.0452,20.0);(189.0219,15.0);(189.0538,30.0);(190.0584,13.0);(191.0336,35.0);(191.0677,19.0);(193.0506,20.0);(199.0409,23.0);(201.0558,19.0);(202.0597,12.0);(203.035,25.0);(204.0417,21.0);(211.0395,14.0);(212.0464,10.0);(215.0351,17.0);(217.0509,19.0);(219.0669,44.0);(227.0375,11.0);(229.0515,14.0);(231.0307,10.0);(237.0762,13.0);(242.017,11.0)
LC-MS/MS	ESI-TOF	Negative	Not Available	View Spectrum	(109.0295,265.0);(110.034,28.0);(111.0455,64.0);(112.049,11.0);(121.0295,61.0);(122.0356,12.0);(123.0092,94.0);(123.0448,16.0);(124.0167,101.0);(125.0249,999.0);(126.0291,96.0);(131.0505,10.0);(133.0292,12.0);(133.0655,14.0);(135.0454,27.0);(137.0248,694.0);(138.0301,135.0);(139.04,289.0);(140.0445,36.0);(143.0499,11.0);(145.0298,11.0);(145.0657,10.0);(147.0449,29.0);(149.0242,49.0);(149.0605,29.0);(150.0304,21.0);(151.0398,56.0);(153.0188,19.0);(159.0454,25.0);(160.0548,12.0);(161.0239,34.0);(161.0594,12.0);(162.0324,25.0);(163.0414,18.0);(164.0116,97.0);(165.0191,214.0);(165.0534,11.0);(166.0259,51.0);(167.0348,247.0);(168.0388,35.0);(171.0461,11.0);(173.0244,15.0);(173.0602,27.0);(174.0305,16.0);(175.0396,61.0);(175.0724,12.0);(176.0451,38.0);(177.0193,49.0);(177.0556,52.0);(178.0266,28.0);(179.0348,62.0);(181.0519,10.0);(187.0396,20.0);(189.0549,34.0);(191.0339,26.0);(191.071,23.0);(192.0402,11.0);(193.0505,26.0);(199.0393,16.0);(201.0561,28.0);(203.0346,42.0);(204.0412,30.0);(205.0487,20.0);(207.0648,14.0);(213.0558,13.0);(215.0348,15.0);(215.0705,10.0);(217.051,31.0);(218.0553,18.0);(219.066,102.0);(220.0705,24.0);(221.0446,41.0);(227.0367,12.0);(229.0499,24.0);(230.0576,10.0);(231.0641,12.0);(233.0456,11.0);(235.0614,11.0);(237.0778,43.0);(238.0815,10.0);(242.0186,12.0);(243.0285,13.0);(243.0656,16.0);(245.0454,13.0);(257.0442,17.0);(274.0504,18.0)
LC-MS/MS	ESI-TOF	Negative	Not Available	View Spectrum	(259.0617,34.0);(261.0771,24.0);(275.0566,33.0);(285.0407,28.0);(303.0527,354.0);(304.0568,92.0);(305.0684,999.0);(306.0729,258.0);(307.0758,42.0);(607.1123,34.0);(608.116,20.0);(609.1272,58.0);(610.1317,32.0);(611.1436,283.0);(612.1484,157.0);(613.1513,53.0);(614.1553,14.0);(913.1859,12.0);(914.1882,11.0);(915.1992,12.0)
LC-MS/MS	ESI-TOF	Negative	Not Available	View Spectrum	(125.0246,44.0);(137.0247,28.0);(165.0195,34.0);(179.0348,27.0);(219.0659,18.0);(221.0456,15.0);(235.0611,17.0);(241.0513,13.0);(257.0461,16.0);(259.0616,24.0);(261.077,43.0);(262.0812,11.0);(274.0488,10.0);(275.0564,53.0);(276.0612,20.0);(285.0409,41.0);(286.0456,15.0);(303.052,141.0);(304.056,58.0);(305.0686,999.0);(306.0728,274.0);(307.0752,24.0)
LC-MS/MS	ESI-TOF	Negative	Not Available	View Spectrum	(125.0246,44.0);(137.0247,28.0);(165.0195,34.0);(179.0348,27.0);(219.0659,18.0);(221.0456,15.0);(235.0611,17.0);(241.0513,13.0);(257.0461,16.0);(259.0616,24.0);(261.077,43.0);(262.0812,11.0);(274.0488,10.0);(275.0564,53.0);(276.0612,20.0);(285.0409,41.0);(286.0456,15.0);(303.052,141.0);(304.056,58.0);(305.0686,999.0);(306.0728,274.0);(307.0752,24.0)
LC-MS/MS	LC-ESI-QFT	positive	low	View Spectrum	(139.0389,32.08067399);(151.039,10.93694154);(169.0494,2.358948175);(181.0494,3.563952004);(289.0706,51.0594843)
LC-MS/MS	LC-ESI-IT	positive	low	View Spectrum	(139.0864,46.77487254);(151.0941,30.47850695);(169.1123,2.446325834);(181.0045,3.073109126);(288.9775,17.22718556)
LC-MS/MS	LC-ESI-QTOF	Negative	medium	View Spectrum	(109.0295,0.26526527);(110.034,0.02802803);(111.0455,0.06406406);(112.049,0.01101101);(121.0295,0.06106106);(122.0356,0.01201201);(123.0092,0.09409409);(123.0448,0.01601602);(124.0167,0.1011011);(125.0249,1.0);(126.0291,0.0960961);(131.0505,0.01001001);(133.0292,0.01201201);(133.0655,0.01401401);(135.0454,0.02702703);(137.0248,0.69469469);(138.0301,0.13513514);(139.04,0.28928929);(140.0445,0.03603604);(143.0499,0.01101101);(145.0298,0.01101101);(145.0657,0.01001001);(147.0449,0.02902903);(149.0242,0.04904905);(149.0605,0.02902903);(150.0304,0.02102102);(151.0398,0.05605606);(153.0188,0.01901902);(159.0454,0.02502503);(160.0548,0.01201201);(161.0239,0.03403403);(161.0594,0.01201201);(162.0324,0.02502503);(163.0414,0.01801802);(164.0116,0.0970971);(165.0191,0.21421421);(165.0534,0.01101101);(166.0259,0.05105105);(167.0348,0.24724725);(168.0388,0.03503504);(171.0461,0.01101101);(173.0244,0.01501502);(173.0602,0.02702703);(174.0305,0.01601602);(175.0396,0.06106106);(175.0724,0.01201201);(176.0451,0.03803804);(177.0193,0.04904905);(177.0556,0.05205205);(178.0266,0.02802803);(179.0348,0.06206206);(181.0519,0.01001001);(187.0396,0.02002002);(189.0549,0.03403403);(191.0339,0.02602603);(191.071,0.02302302);(192.0402,0.01101101);(193.0505,0.02602603);(199.0393,0.01601602);(201.0561,0.02802803);(203.0346,0.04204204);(204.0412,0.03003003);(205.0487,0.02002002);(207.0648,0.01401401);(213.0558,0.01301301);(215.0348,0.01501502);(215.0705,0.01001001);(217.051,0.03103103);(218.0553,0.01801802);(219.066,0.1021021);(220.0705,0.02402402);(221.0446,0.04104104);(227.0367,0.01201201);(229.0499,0.02402402);(230.0576,0.01001001);(231.0641,0.01201201);(233.0456,0.01101101);(235.0614,0.01101101);(237.0778,0.04304304);(238.0815,0.01001001);(242.0186,0.01201201);(243.0285,0.01301301);(243.0656,0.01601602);(245.0454,0.01301301);(257.0442,0.01701702);(274.0504,0.01801802)
LC-MS/MS	LC-ESI-QTOF	Negative	medium	View Spectrum	(109.0295,0.09409409);(110.0347,0.01001001);(111.0452,0.03203203);(121.0294,0.02502503);(123.0087,0.03503504);(123.0452,0.01301301);(124.0156,0.02502503);(125.025,1.0);(126.0292,0.1021021);(135.0462,0.01601602);(137.0249,0.51851852);(138.0299,0.08208208);(139.0403,0.22222222);(140.0448,0.02702703);(147.0474,0.01001001);(149.0248,0.03703704);(150.0321,0.02102102);(151.0394,0.04404404);(153.0182,0.01201201);(159.0447,0.01501502);(161.024,0.02802803);(162.0293,0.01001001);(163.0398,0.02102102);(164.0107,0.06106106);(165.0198,0.39239239);(166.0244,0.07007007);(167.0351,0.28928929);(168.0398,0.03503504);(173.0617,0.01401401);(175.0399,0.04404404);(175.0778,0.01401401);(176.0457,0.01101101);(177.0193,0.07207207);(177.0553,0.05905906);(178.025,0.02702703);(178.0609,0.01001001);(179.0353,0.23623624);(180.0387,0.04704705);(181.0507,0.01701702);(185.0611,0.01301301);(189.0562,0.03003003);(191.0351,0.03703704);(191.0717,0.02802803);(193.0512,0.02502503);(199.0405,0.01901902);(200.0473,0.01001001);(201.0546,0.02402402);(203.0352,0.04904905);(204.0423,0.04504505);(205.0491,0.02002002);(207.0659,0.04004004);(208.0709,0.01201201);(213.0559,0.01701702);(215.0359,0.01101101);(215.0709,0.01301301);(217.0508,0.06206206);(218.0564,0.03503504);(219.0298,0.01401401);(219.0668,0.24324324);(220.0708,0.05905906);(221.0461,0.16116116);(222.0505,0.03703704);(228.042,0.01101101);(229.0509,0.02002002);(230.0582,0.01101101);(231.0666,0.03303303);(232.0719,0.01001001);(233.0465,0.03203203);(233.0808,0.02202202);(234.0484,0.01201201);(235.0617,0.04604605);(236.0649,0.01701702);(237.0769,0.07007007);(238.0807,0.01801802);(239.0347,0.01001001);(241.0508,0.03503504);(242.0228,0.01101101);(242.0551,0.01101101);(243.0298,0.02002002);(243.0654,0.04504505);(244.0713,0.01501502);(245.0458,0.01901902);(247.0242,0.01701702);(257.0457,0.06706707);(258.0511,0.02202202);(259.0261,0.01101101);(259.0594,0.02102102);(261.0411,0.01101101);(261.0773,0.14514515);(262.0811,0.04004004);(263.0566,0.02502503);(274.049,0.07607608);(275.0562,0.08208208);(276.0612,0.02102102);(285.0411,0.04504505);(286.0447,0.01601602);(287.0557,0.02102102);(288.0619,0.01001001);(303.0506,0.02402402);(304.0565,0.01301301);(305.0674,0.38938939);(306.0711,0.11611612)
LC-MS/MS	LC-ESI-QTOF	Negative	low	View Spectrum	(125.0246,0.04404404);(137.0247,0.02802803);(165.0195,0.03403403);(179.0348,0.02702703);(219.0659,0.01801802);(221.0456,0.01501502);(235.0611,0.01701702);(241.0513,0.01301301);(257.0461,0.01601602);(259.0616,0.02402402);(261.077,0.04304304);(262.0812,0.01101101);(274.0488,0.01001001);(275.0564,0.05305305);(276.0612,0.02002002);(285.0409,0.04104104);(286.0456,0.01501502);(303.052,0.14114114);(304.056,0.05805806);(305.0686,1.0);(306.0728,0.27427427);(307.0752,0.02402402)
LC-MS/MS	LC-ESI-QTOF	Negative	high	View Spectrum	(107.0506,0.02402402);(108.0224,0.02402402);(109.0298,0.66066066);(110.0347,0.08408408);(111.0456,0.07207207);(115.0544,0.01401401);(117.0346,0.02402402);(119.0504,0.03503504);(120.0236,0.01201201);(121.0298,0.16516517);(121.0654,0.02702703);(122.0355,0.02802803);(123.0082,0.1991992);(123.0458,0.02902903);(124.0166,0.24324324);(125.0247,1.0);(126.0285,0.0950951);(130.0435,0.01701702);(131.0505,0.03103103);(132.0551,0.01101101);(133.0293,0.04204204);(133.0665,0.02502503);(134.0372,0.01101101);(135.0074,0.01201201);(135.0456,0.03203203);(137.0247,0.87487487);(137.0619,0.01001001);(138.0314,0.23423423);(139.0401,0.48048048);(139.0604,0.01001001);(140.0465,0.04504505);(143.0497,0.02102102);(145.0293,0.05005005);(145.0653,0.02002002);(146.0386,0.02202202);(147.0443,0.04504505);(148.0534,0.01501502);(149.0245,0.07307307);(149.0602,0.03603604);(150.0313,0.03703704);(151.0397,0.09109109);(152.0427,0.01901902);(153.019,0.03903904);(155.0341,0.01501502);(157.0648,0.01901902);(158.0371,0.02302302);(159.0443,0.05905906);(160.0509,0.01801802);(161.0245,0.0970971);(161.0608,0.02002002);(162.031,0.02402402);(163.0402,0.02702703);(163.0773,0.01401401);(164.0109,0.11411411);(164.0475,0.02302302);(165.0192,0.13613614);(165.0539,0.01801802);(166.0267,0.05505506);(167.0354,0.15615616);(168.0389,0.02002002);(170.0306,0.01101101);(171.0469,0.01301301);(172.0512,0.02302302);(173.0246,0.02202202);(173.0604,0.03403403);(174.0341,0.02202202);(175.0407,0.08608609);(176.0452,0.03603604);(177.0181,0.04604605);(177.0554,0.04404404);(178.025,0.02902903);(179.0354,0.01601602);(186.0316,0.01401401);(187.0393,0.04004004);(188.0452,0.02002002);(189.0219,0.01501502);(189.0538,0.03003003);(190.0584,0.01301301);(191.0336,0.03503504);(191.0677,0.01901902);(193.0506,0.02002002);(199.0409,0.02302302);(201.0558,0.01901902);(202.0597,0.01201201);(203.035,0.02502503);(204.0417,0.02102102);(211.0395,0.01401401);(212.0464,0.01001001);(215.0351,0.01701702);(217.0509,0.01901902);(219.0669,0.04404404);(227.0375,0.01101101);(229.0515,0.01401401);(231.0307,0.01001001);(237.0762,0.01301301);(242.017,0.01101101)
LC-MS/MS	LC-ESI-UNKNOWN	Negative	high	View Spectrum	(107.051,0.024);(108.022,0.024);(109.03,0.661);(110.035,0.084);(111.046,0.072);(115.054,0.014);(117.035,0.024);(119.05,0.035);(120.024,0.012);(121.03,0.165);(121.065,0.027);(122.036,0.028);(123.008,0.199);(123.046,0.029);(124.017,0.243);(125.025,1.0);(126.028,0.095);(130.044,0.017);(131.05,0.031);(132.055,0.011);(133.029,0.042);(133.066,0.025);(134.037,0.011);(135.007,0.012);(135.046,0.032);(137.025,0.875);(137.062,0.01);(138.031,0.234);(139.04,0.48);(139.06,0.01);(140.046,0.045);(143.05,0.021);(145.029,0.05);(145.065,0.02);(146.039,0.022);(147.044,0.045);(148.053,0.015);(149.024,0.073);(149.06,0.036);(150.031,0.037);(151.04,0.091);(152.043,0.019);(153.019,0.039);(155.034,0.015);(157.065,0.019);(158.037,0.023);(159.044,0.059);(160.051,0.018);(161.024,0.097);(161.061,0.02);(162.031,0.024);(163.04,0.027);(163.077,0.014);(164.011,0.114);(164.048,0.023);(165.019,0.136);(165.054,0.018);(166.027,0.055);(167.035,0.156);(168.039,0.02);(170.031,0.011);(171.047,0.013);(172.051,0.023);(173.025,0.022);(173.06,0.034);(174.034,0.022);(175.041,0.086);(176.045,0.036);(177.018,0.046);(177.055,0.044);(178.025,0.029);(179.035,0.016);(186.032,0.014);(187.039,0.04);(188.045,0.02);(189.022,0.015);(189.054,0.03);(190.058,0.013);(191.034,0.035);(191.068,0.019);(193.051,0.02);(199.041,0.023);(201.056,0.019);(202.06,0.012);(203.035,0.025);(204.042,0.021);(211.04,0.014);(212.046,0.01);(215.035,0.017);(217.051,0.019);(219.067,0.044);(227.038,0.011);(229.052,0.014);(231.031,0.01);(237.076,0.013);(242.017,0.011)
LC-MS/MS	LC-ESI-UNKNOWN	Negative	medium	View Spectrum	(109.03,0.265);(110.034,0.028);(111.046,0.064);(112.049,0.011);(121.03,0.061);(122.036,0.012);(123.009,0.094);(123.045,0.016);(124.017,0.101);(125.025,1.0);(126.029,0.096);(131.05,0.01);(133.029,0.012);(133.066,0.014);(135.045,0.027);(137.025,0.695);(138.03,0.135);(139.04,0.289);(140.044,0.036);(143.05,0.011);(145.03,0.011);(145.066,0.01);(147.045,0.029);(149.024,0.049);(149.06,0.029);(150.03,0.021);(151.04,0.056);(153.019,0.019);(159.045,0.025);(160.055,0.012);(161.024,0.034);(161.059,0.012);(162.032,0.025);(163.041,0.018);(164.012,0.097);(165.019,0.214);(165.053,0.011);(166.026,0.051);(167.035,0.247);(168.039,0.035);(171.046,0.011);(173.024,0.015);(173.06,0.027);(174.03,0.016);(175.04,0.061);(175.072,0.012);(176.045,0.038);(177.019,0.049);(177.056,0.052);(178.027,0.028);(179.035,0.062);(181.052,0.01);(187.04,0.02);(189.055,0.034);(191.034,0.026);(191.071,0.023);(192.04,0.011);(193.05,0.026);(199.039,0.016);(201.056,0.028);(203.035,0.042);(204.041,0.03);(205.049,0.02);(207.065,0.014);(213.056,0.013);(215.035,0.015);(215.07,0.01);(217.051,0.031);(218.055,0.018);(219.066,0.102);(220.07,0.024);(221.045,0.041);(227.037,0.012);(229.05,0.024);(230.058,0.01);(231.064,0.012);(233.046,0.011);(235.061,0.011);(237.078,0.043);(238.082,0.01);(242.019,0.012);(243.028,0.013);(243.066,0.016);(245.045,0.013);(257.044,0.017);(274.05,0.018)
LC-MS/MS	LC-ESI-UNKNOWN	Negative	low	View Spectrum	(125.025,0.044);(137.025,0.028);(165.02,0.034);(179.035,0.027);(219.066,0.018);(221.046,0.015);(235.061,0.017);(241.051,0.013);(257.046,0.016);(259.062,0.024);(261.077,0.043);(262.081,0.011);(274.049,0.01);(275.056,0.053);(276.061,0.02);(285.041,0.041);(286.046,0.015);(303.052,0.141);(304.056,0.058);(305.069,1.0);(306.073,0.274);(307.075,0.024)
LC-MS/MS	LC-ESI-UNKNOWN	Negative	medium	View Spectrum	(109.03,0.094);(110.035,0.01);(111.045,0.032);(121.029,0.025);(123.009,0.035);(123.045,0.013);(124.016,0.025);(125.025,1.0);(126.029,0.102);(135.046,0.016);(137.025,0.519);(138.03,0.082);(139.04,0.222);(140.045,0.027);(147.047,0.01);(149.025,0.037);(150.032,0.021);(151.039,0.044);(153.018,0.012);(159.045,0.015);(161.024,0.028);(162.029,0.01);(163.04,0.021);(164.011,0.061);(165.02,0.392);(166.024,0.07);(167.035,0.289);(168.04,0.035);(173.062,0.014);(175.04,0.044);(175.078,0.014);(176.046,0.011);(177.019,0.072);(177.055,0.059);(178.025,0.027);(178.061,0.01);(179.035,0.236);(180.039,0.047);(181.051,0.017);(185.061,0.013);(189.056,0.03);(191.035,0.037);(191.072,0.028);(193.051,0.025);(199.04,0.019);(200.047,0.01);(201.055,0.024);(203.035,0.049);(204.042,0.045);(205.049,0.02);(207.066,0.04);(208.071,0.012);(213.056,0.017);(215.036,0.011);(215.071,0.013);(217.051,0.062);(218.056,0.035);(219.03,0.014);(219.067,0.243);(220.071,0.059);(221.046,0.161);(222.05,0.037);(228.042,0.011);(229.051,0.02);(230.058,0.011);(231.067,0.033);(232.072,0.01);(233.046,0.032);(233.081,0.022);(234.048,0.012);(235.062,0.046);(236.065,0.017);(237.077,0.07);(238.081,0.018);(239.035,0.01);(241.051,0.035);(242.023,0.011);(242.055,0.011);(243.03,0.02);(243.065,0.045);(244.071,0.015);(245.046,0.019);(247.024,0.017);(257.046,0.067);(258.051,0.022);(259.026,0.011);(259.059,0.021);(261.041,0.011);(261.077,0.145);(262.081,0.04);(263.057,0.025);(274.049,0.076);(275.056,0.082);(276.061,0.021);(285.041,0.045);(286.045,0.016);(287.056,0.021);(288.062,0.01);(303.051,0.024);(304.056,0.013);(305.067,0.389);(306.071,0.116)
Predicted LC-MS/MS	Not Available	Positive	low	View Spectrum	(111.0446045,0.2647970376);(113.0602545,0.1650368067);(123.0446045,5.566402464);(125.023869,2.799953963);(125.0602545,1.424253871);(127.0395191,0.8192008159);(127.0759046,1.263913106);(135.0446045,0.2109896628);(139.0395191,16.518263);(141.0551691,1.157076763);(143.0708192,0.8529936292);(149.023869,0.5276584219);(151.0395191,0.731541179);(153.0187836,0.660227421);(153.0551691,0.4182880531);(155.0344337,2.352853758);(159.0657338,0.1778279213);(163.0395191,0.9681424561);(169.0500838,0.3506191222);(179.0344337,0.1996220101);(181.0500838,1.165733695);(185.0449984,0.3168899902);(195.0293483,0.2610695684);(197.0449984,0.6863881665);(263.0555631,0.3000402558);(271.0606485,0.4329405142);(275.0555631,0.5909032705);(277.0712131,0.8678340445);(289.0712131,11.60366711);(291.0504777,0.453688493);(307.0817778,45.89118343)
Predicted LC-MS/MS	Not Available	Positive	med	View Spectrum	(43.01838972,0.6556503351);(61.0289544,0.4885287344);(111.0446045,0.4687773879);(123.0446045,5.82911917);(125.023869,3.839841614);(125.0602545,0.6791515406);(127.0395191,1.482455718);(127.0759046,0.8177751377);(135.0446045,0.6575103173);(139.0395191,44.19329034);(141.0551691,1.78344232);(143.0708192,2.171338159);(149.023869,0.683101245);(151.0395191,2.279676596);(153.0187836,1.857784393);(153.0551691,0.9913462703);(155.0344337,5.297620556);(163.0395191,1.061943964);(167.0344337,0.8954631463);(169.0500838,2.11015058);(181.0500838,0.8252612336);(185.0449984,0.6081315338);(205.0500838,0.489570761);(263.0555631,0.8765357154);(265.0712131,0.6102944063);(271.0606485,0.5628379894);(275.0555631,0.6739724987);(277.0712131,2.643235917);(289.0712131,5.234731569);(291.0504777,0.4853314547);(307.0817778,8.746129401)
Predicted LC-MS/MS	Not Available	Positive	high	View Spectrum	(53.03912516,2.069227231);(67.01838972,1.528870022);(69.03403978,4.043382722);(80.99765427,1.273315106);(81.03403978,2.30680971);(93.03403978,3.072396872);(95.01330434,2.278144473);(95.04968984,2.802881897);(97.0289544,4.035835874);(107.0496898,7.320179977);(109.0289544,2.247410271);(109.0653399,2.171099537);(111.0446045,1.180643767);(123.0446045,15.89068316);(125.023869,6.264723428);(125.0602545,2.75637535);(127.0395191,1.357689176);(127.0759046,1.407341938);(135.0446045,2.607052225);(137.0602545,1.549242585);(139.0395191,9.974597782);(141.0551691,2.419383465);(143.0708192,1.070968205);(149.023869,3.912152451);(151.0395191,3.766157406);(153.0187836,1.621908601);(155.0344337,1.408851535);(163.0395191,4.370881502);(165.0187836,1.309870109);(263.0555631,1.034282952);(265.0712131,0.9476406718)
Predicted LC-MS/MS	Not Available	Negative	low	View Spectrum	(109.0289544,0.1470292307);(121.0289544,1.401572617);(123.0446045,0.1689254227);(125.023869,2.184251166);(125.0602545,0.1750773706);(137.023869,5.755437054);(139.0395191,1.678544704);(141.0551691,0.140208933);(151.0031336,0.1150073219);(151.0395191,0.1277052747);(153.0187836,0.9217891543);(163.0395191,0.1614681911);(167.0344337,1.057240518);(179.0344337,1.536257396);(181.0500838,0.8252640378);(183.0293483,1.421238984);(217.0500838,0.1963173124);(219.0657338,0.3299407375);(231.0293483,0.1136583953);(233.0449984,0.3498597821);(235.0606485,0.2097846991);(245.0449984,0.0844288422);(247.0606485,0.339446399);(261.039913,0.3378776643);(263.0555631,0.4773493217);(273.039913,0.5087694842);(275.0555631,2.05801646);(287.0555631,6.282580125);(287.0555631,0.2078638771);(289.0348276,0.1273528938);(305.0661278,70.55973663)
Predicted LC-MS/MS	Not Available	Negative	med	View Spectrum	(17.00273965,0.5670835193);(41.00273965,0.6037448033);(43.01838972,1.519315966);(109.0289544,1.372857958);(111.0446045,0.5406867263);(121.0289544,1.671707619);(123.008219,0.4269807484);(123.0446045,0.9022987768);(125.023869,5.168981783);(137.023869,20.48029791);(139.0395191,1.513129209);(149.023869,1.775865419);(151.0395191,0.9522217714);(153.0187836,3.000763046);(161.023869,0.479158336);(163.0395191,0.4556689157);(165.0187836,2.540474781);(167.0344337,16.6835996);(179.0344337,4.431298294);(181.0500838,0.9477433403);(219.0657338,0.4733370055);(245.0449984,0.6279409978);(247.0606485,0.8263460189);(261.039913,2.117250663);(263.0555631,2.200076481);(273.039913,0.9784437524);(275.0555631,1.29678251);(287.0555631,5.806695276);(289.0348276,1.059798923);(289.0348276,0.542840867);(305.0661278,18.03660899)
Predicted LC-MS/MS	Not Available	Negative	high	View Spectrum	(41.00273965,2.055039876);(43.01838972,1.295913026);(57.03403978,1.308306756);(65.00273965,0.7652990332);(67.01838972,5.272035561);(83.01330434,5.716814875);(91.01838972,1.876069194);(93.03403978,2.65331239);(95.01330434,1.513996711);(105.0340398,1.086327239);(107.0133043,9.652656276);(109.0289544,6.325626418);(111.0446045,2.212198935);(121.0289544,5.92318262);(123.0446045,1.922275939);(125.023869,21.1093407);(125.0602545,0.8915205674);(137.023869,7.150824917);(139.0395191,2.217853233);(141.0551691,1.033731995);(149.023869,1.483861957);(153.0187836,1.847081579);(161.023869,0.7903886425);(167.0344337,2.256454111);(179.0344337,1.631338262);(231.0293483,1.291660653);(261.039913,2.378229051);(263.0555631,3.141103939);(273.039913,0.8483731509);(275.0555631,1.062107941);(287.0555631,1.287074451)
Predicted LC-MS/MS	Not Available	Positive	low	View Spectrum	(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(289.07066,31.21);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0);(307.08123,100.0)
Predicted LC-MS/MS	Not Available	Positive	medium	View Spectrum	(111.04406,7.21);(111.04406,7.21);(111.04406,7.21);(123.04406,13.95);(123.04406,13.95);(123.04406,13.95);(123.04406,13.95);(137.02332,27.14);(137.02332,27.14);(137.02332,27.14);(137.02332,27.14);(137.02332,27.14);(137.02332,27.14);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(141.05462,20.73);(141.05462,20.73);(141.05462,20.73);(141.05462,20.73);(141.05462,20.73);(141.05462,20.73);(141.05462,20.73);(141.05462,20.73);(141.05462,20.73);(141.05462,20.73);(141.05462,20.73);(149.02332,10.55);(149.02332,10.55);(149.02332,10.55);(149.02332,10.55);(151.03897,16.84);(151.03897,16.84);(151.03897,16.84);(151.03897,16.84);(163.03897,9.87);(163.03897,9.87);(165.01824,11.48);(165.01824,11.48);(165.01824,11.48);(165.01824,11.48);(165.01824,11.48);(165.01824,11.48);(167.03389,19.45);(167.03389,19.45);(167.03389,19.45);(167.03389,19.45);(167.03389,19.45);(167.03389,19.45);(169.04954,33.83);(169.04954,33.83);(169.04954,33.83);(169.04954,33.83);(169.04954,33.83);(169.04954,33.83);(169.04954,33.83);(169.04954,33.83);(181.04954,16.59);(181.04954,16.59);(181.04954,16.59);(181.04954,16.59);(181.04954,16.59);(181.04954,16.59);(181.04954,16.59);(181.04954,16.59);(181.04954,16.59);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(279.08631,6.98);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(289.07066,7.86);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89);(307.08123,76.89)
Predicted LC-MS/MS	Not Available	Positive	high	View Spectrum	(43.01784,11.65);(45.03349,4.15);(55.05423,4.99);(67.01784,6.48);(67.01784,6.48);(71.01276,6.27);(71.01276,6.27);(81.03349,5.96);(81.03349,5.96);(109.02841,4.58);(109.02841,4.58);(109.02841,4.58);(109.02841,4.58);(121.02841,6.55);(121.02841,6.55);(123.04406,14.3);(123.04406,14.3);(123.04406,14.3);(123.04406,14.3);(125.02332,5.72);(125.02332,5.72);(125.02332,5.72);(125.02332,5.72);(137.02332,17.88);(137.02332,17.88);(137.02332,17.88);(137.02332,17.88);(137.02332,17.88);(137.02332,17.88);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(139.03897,100.0);(141.05462,15.5);(141.05462,15.5);(141.05462,15.5);(141.05462,15.5);(141.05462,15.5);(141.05462,15.5);(141.05462,15.5);(141.05462,15.5);(141.05462,15.5);(141.05462,15.5);(141.05462,15.5);(151.03897,6.82);(151.03897,6.82);(151.03897,6.82);(151.03897,6.82);(155.03389,10.92);(155.03389,10.92);(155.03389,10.92);(155.03389,10.92);(163.03897,5.95);(163.03897,5.95);(165.01824,4.7);(165.01824,4.7);(165.01824,4.7);(165.01824,4.7);(165.01824,4.7);(165.01824,4.7);(165.05462,12.51);(165.05462,12.51);(167.03389,6.54);(167.03389,6.54);(167.03389,6.54);(167.03389,6.54);(167.03389,6.54);(167.03389,6.54);(169.04954,12.76);(169.04954,12.76);(169.04954,12.76);(169.04954,12.76);(169.04954,12.76);(169.04954,12.76);(169.04954,12.76);(169.04954,12.76);(179.03389,6.43);(179.03389,6.43);(179.03389,6.43);(179.03389,6.43);(179.03389,6.43);(179.03389,6.43);(179.03389,6.43);(179.03389,6.43);(205.04954,15.07);(205.04954,15.07);(237.07575,7.79);(237.07575,7.79);(245.04445,5.19);(245.04445,5.19);(247.0601,6.22);(247.0601,6.22);(247.0601,6.22);(247.0601,6.22);(249.07575,5.99);(249.07575,5.99);(249.07575,5.99);(261.03936,4.96);(261.03936,4.96);(261.03936,4.96);(261.03936,4.96);(265.07066,5.8);(265.07066,5.8);(265.07066,5.8);(265.07066,5.8);(265.07066,5.8);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(279.08631,4.79);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26);(289.07066,5.26)
Predicted LC-MS/MS	Not Available	Negative	low	View Spectrum	(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(287.05611,14.46);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0);(305.06668,100.0)
Predicted LC-MS/MS	Not Available	Negative	medium	View Spectrum	(125.02442,8.76);(125.02442,8.76);(125.02442,8.76);(125.02442,8.76);(125.02442,8.76);(137.02442,44.05);(137.02442,44.05);(137.02442,44.05);(139.04007,20.39);(139.04007,20.39);(139.04007,20.39);(139.04007,20.39);(161.02442,10.36);(161.02442,10.36);(161.02442,10.36);(163.04007,11.4);(163.04007,11.4);(165.01933,6.96);(165.01933,6.96);(167.03498,6.83);(167.03498,6.83);(167.03498,6.83);(179.03498,17.61);(179.03498,17.61);(179.03498,17.61);(179.03498,17.61);(179.03498,17.61);(179.03498,17.61);(179.03498,17.61);(179.03498,17.61);(179.03498,17.61);(181.05063,10.39);(181.05063,10.39);(181.05063,10.39);(181.05063,10.39);(181.05063,10.39);(181.05063,10.39);(181.05063,10.39);(181.05063,10.39);(235.0612,6.8);(235.0612,6.8);(259.0612,6.29);(259.0612,6.29);(259.0612,6.29);(261.04046,7.52);(261.04046,7.52);(261.04046,7.52);(261.04046,7.52);(261.04046,7.52);(263.05611,14.47);(263.05611,14.47);(263.05611,14.47);(263.05611,14.47);(263.05611,14.47);(269.04555,6.64);(269.04555,6.64);(269.04555,6.64);(277.07176,8.95);(277.07176,8.95);(277.07176,8.95);(277.07176,8.95);(277.07176,8.95);(277.07176,8.95);(277.07176,8.95);(277.07176,8.95);(277.07176,8.95);(277.07176,8.95);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(287.05611,100.0);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77);(305.06668,70.77)
Predicted LC-MS/MS	Not Available	Negative	high	View Spectrum	(41.00329,24.56);(43.01894,14.38);(53.00329,11.93);(65.00329,16.71);(107.01385,12.7);(107.01385,12.7);(109.0295,18.92);(109.0295,18.92);(109.0295,18.92);(121.0295,20.23);(121.0295,20.23);(121.0295,20.23);(121.0295,20.23);(121.0295,20.23);(123.04515,67.27);(123.04515,67.27);(125.02442,19.89);(125.02442,19.89);(125.02442,19.89);(125.02442,19.89);(125.02442,19.89);(125.0608,16.47);(137.02442,100.0);(137.02442,100.0);(137.02442,100.0);(139.04007,31.91);(139.04007,31.91);(139.04007,31.91);(139.04007,31.91);(141.05572,20.7);(149.02442,21.59);(149.02442,21.59);(149.02442,21.59);(165.01933,12.57);(165.01933,12.57);(183.0299,11.78);(203.03498,16.27);(203.03498,16.27);(205.05063,12.38);(235.0612,51.81);(235.0612,51.81);(247.0612,9.47);(263.05611,11.49);(263.05611,11.49);(263.05611,11.49);(263.05611,11.49);(263.05611,11.49);(273.04046,9.24);(273.04046,9.24);(273.04046,9.24);(273.04046,9.24);(275.05611,13.05);(275.05611,13.05);(275.05611,13.05);(275.05611,13.05);(275.05611,13.05);(275.05611,13.05);(275.05611,13.05);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(287.05611,16.94);(289.03538,9.01);(289.03538,9.01);(289.03538,9.01);(303.05103,10.81);(303.05103,10.81);(303.05103,10.81);(303.05103,10.81);(303.05103,10.81);(303.05103,10.81);(303.05103,10.81)

Food Sources

No food source information available

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
	(−)-Gallocatechin		(−)-Gallocatechin	human	urine	host metabolism	Not Available	Not Available	<1%	C₁₅H₁₄O₇	306.073952791	Detailed Intervention Studies	Publications

Inter-Individual Variations in Metabolism

	Food Phytochemical		Metabolite	Effect	Value

Back

Showing entry for (−)-Gallocatechin

Identification

Structure for (−)-Gallocatechin

Calculated Properties

External Links

Taxonomy as Food Phytochemical

Taxonomy as Metabolite

Taxonomy of its Food Phytochemical Precursor(s)

Spectra from Phytohub

Food Sources

Food Sources of its Food Phytochemical(s)

Role as Biomarker of intake

Metabolism

Inter-Individual Variations in Metabolism