Exact Mass: 638.112777

Exact Mass Matches: 638.112777

Found 66 metabolites which its exact mass value is equals to given mass value 638.112777, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Luteolin 7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide]

Luteolin 7-O-[β-D-glucuronosyl-(1->2)-β-D-glucuronide]

C27H26O18 (638.1119096)


This compound belongs to the family of Flavonoid O-Glycosides. These are compounds containing a carbohydrate moiety which is o-glycosidically linked to one of the flavonoid backbones (2-phenylchromen-4-one, 3-phenylchromen-4-one or 4-phenylcoumarin).

   

Chesnatin

3-(6-{[(3,5-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methoxy]carbonyl}-2,3,4-trihydroxyphenoxy)-4,5-dihydroxybenzoic acid

C27H26O18 (638.1119096)


Chesnatin is found in nuts. Chesnatin is a tannin constituent of Japanese chestnut galls (Castanea crenata) and from the leaf of Castanea mollissima (Chinese chestnut). A tannin constituent of Japanese chestnut galls (Castanea crenata) and from the leaf of Castanea mollissima (Chinese chestnut). Chesnatin is found in nuts.

   

Isochesnatin

2-(5-{[(3,5-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methoxy]carbonyl}-2,3-dihydroxyphenoxy)-3,4,5-trihydroxybenzoic acid

C27H26O18 (638.1119096)


Isochesnatin is found in nuts. Isochesnatin is isolated from the leaf of Castanea mollissima (Chinese chestnut). Isolated from the leaf of Castanea mollissima (Chinese chestnut). Isochesnatin is found in nuts.

   

Scutellarein 7-glucuronosyl-(1->2)-glucuronide

6-[(6-carboxy-2-{[5,6-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-4,5-dihydroxyoxan-3-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C27H26O18 (638.1119096)


Scutellarein 7-glucuronosyl-(1->2)-glucuronide is found in fats and oils. Scutellarein 7-glucuronosyl-(1->2)-glucuronide is a constituent of Perilla frutescens (perilla).

   

Fodipir

2-({2-[(carboxymethyl)({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)amino]ethyl}({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)amino)acetic acid

C22H32N4O14P2 (638.1390192)


   

Luteolin 7-O-diglucuronide

(2S,3S,4S,5R,6S)-6-[(2S,3S,4S,5R,6S)-6-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carbonyloxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C27H26O18 (638.1119096)


Luteolin 7-o-diglucuronide is a member of the class of compounds known as flavonoid-7-o-glucuronides. Flavonoid-7-o-glucuronides are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid at the C7-position. Luteolin 7-o-diglucuronide is slightly soluble (in water) and a moderately acidic compound (based on its pKa). Luteolin 7-o-diglucuronide can be found in common verbena and lemon verbena, which makes luteolin 7-o-diglucuronide a potential biomarker for the consumption of these food products.

   

bisorganyltrisulfane

Bisorganyltrisulphane

C20H26N6O12S3 (638.0770796)


Bisorganyltrisulfane is a member of the class of compounds known as oligopeptides. Oligopeptides are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds. Bisorganyltrisulfane is practically insoluble (in water) and a moderately acidic compound (based on its pKa). Bisorganyltrisulfane can be found in a number of food items such as rocket salad (sspecies), dandelion, cloves, and chickpea, which makes bisorganyltrisulfane a potential biomarker for the consumption of these food products.

   

Herbacetin 7-(6-quinoylglucoside)

3,5,7,8,4-Pentahydroxyflavone 7- (6"-quinoylglucoside)

C28H30O17 (638.148293)


   

Scutellarein 7-glucuronide-6-ferulate

Scutellarein 7-glucuronide-6-ferulate

C31H26O15 (638.1271646)


   

Luteolin 7,3-diglucuronide

3,7-Bis (beta-D-glucopyranuronosyloxy) -4,5-dihydroxyflavone

C27H26O18 (638.1119096)


   

Luteolin 3,4-diglucuronide

Luteolin 3,4-diglucuronide

C27H26O18 (638.1119096)


   

Isoetin 7-glucoside-2-(4-acetylxyloside)

Isoetin 7-glucoside-2-(4-acetylxyloside)

C28H30O17 (638.148293)


   

Luteolin 7,4-diglucuronide

4,7-Bis (beta-D-glucopyranuronosyloxy) -3,5-dihydroxyflavone

C27H26O18 (638.1119096)


   

Kaempferide 5-glucoside-7-glucuronide

5- (beta-D-Glucopyranosyloxy) -7- (beta-D-glucopyranuronosyloxy) -3-hydroxy-4-methoxyflavone

C28H30O17 (638.148293)


   

Luteolin 7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide]

5,7,3,4-Tetrahydroxyflavone 7-glucuronosyl- (1->2) -glucuronide

C27H26O18 (638.1119096)


This compound belongs to the family of Flavonoid O-Glycosides. These are compounds containing a carbohydrate moiety which is o-glycosidically linked to one of the flavonoid backbones (2-phenylchromen-4-one, 3-phenylchromen-4-one or 4-phenylcoumarin). Luteolin 7-diglucuronide is the major flavonoid isolated from Aloysia triphylla and Verbena officinalis[1].

   

Luteolin 3,4-digalacturonide

3,4-Bis (beta-D-galactopyranuronosyloxy) -5,7-dihydroxyflavone

C27H26O18 (638.1119096)


   

2)-glucuronide

5,6-Dihydroxy-2- (4-hydroxyphenyl) -4-oxo-4H-1-benzopyran-7-yl 2-O-beta-D-glucopyranuronosyl-beta-D-Glucopyranosiduronic acid

C27H26O18 (638.1119096)


   
   

isoetin 7-beta-D-glucopyranoside-2-beta-D-(4-acetylxylopyranoside)

isoetin 7-beta-D-glucopyranoside-2-beta-D-(4-acetylxylopyranoside)

C28H30O17 (638.148293)


   

quercetin 3-O-[2-O-acetyl-alpha-L-arabinopyranosyl-(1->6)-beta-D-glucopyranoside]

quercetin 3-O-[2-O-acetyl-alpha-L-arabinopyranosyl-(1->6)-beta-D-glucopyranoside]

C28H30O17 (638.148293)


   

(11S,13R,14S,15S,16R)-11,13,15,16-tetrachlorodocosane-1,14-disulfate

(11S,13R,14S,15S,16R)-11,13,15,16-tetrachlorodocosane-1,14-disulfate

C22H42Cl4O8S2 (638.1075092000001)


   

Quercetin-7-O-??-L-Arabinosyl-3-O-??-D-6-acetyl glucopyranoside

Quercetin-7-O-??-L-Arabinosyl-3-O-??-D-6-acetyl glucopyranoside

C28H30O17 (638.148293)


   
   
   

scutellarein 6,7-di-O-beta-D-glucuronide|scutellarein-6,7-di-O-beta-D-glucuronide|scutellarein-6,7-di-O-beta-glucuronide

scutellarein 6,7-di-O-beta-D-glucuronide|scutellarein-6,7-di-O-beta-D-glucuronide|scutellarein-6,7-di-O-beta-glucuronide

C27H26O18 (638.1119096)


   
   

(-)-4beta-(2-hydroxyethylsulfanyl)-6-<1-(2-hydroxyethylsulfanyl)ethyl>epigallocatechin 3-O-gallate

(-)-4beta-(2-hydroxyethylsulfanyl)-6-<1-(2-hydroxyethylsulfanyl)ethyl>epigallocatechin 3-O-gallate

C28H30O13S2 (638.112777)


   

(-)-4beta-(2-hydroxyethylsulfanyl)-8-<1-(2-hydroxyethylsulfanyl)ethyl>epigallocatechin 3-O-gallate

(-)-4beta-(2-hydroxyethylsulfanyl)-8-<1-(2-hydroxyethylsulfanyl)ethyl>epigallocatechin 3-O-gallate

C28H30O13S2 (638.112777)


   
   

quercetin 3-O-[4-O-acetyl-alpha-L-arabinopyranosyl]-(1->6)-beta-D-galactopyranoside

quercetin 3-O-[4-O-acetyl-alpha-L-arabinopyranosyl]-(1->6)-beta-D-galactopyranoside

C28H30O17 (638.148293)


   

chrysoeriol 7-O-beta-D-glucopyranosiduronic acid-(1->2)-beta-D-glucopyranoside

chrysoeriol 7-O-beta-D-glucopyranosiduronic acid-(1->2)-beta-D-glucopyranoside

C28H30O17 (638.148293)


   
   

3,3-di-O-methyl ellagic acid 4-rutinoside

3,3-di-O-methyl ellagic acid 4-rutinoside

C28H30O17 (638.148293)


   

Isochesnatin

2-(5-{[(3,5-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methoxy]carbonyl}-2,3-dihydroxyphenoxy)-3,4,5-trihydroxybenzoic acid

C27H26O18 (638.1119096)


   

quercetin 3-O-beta-(2-acetyl)galactopyranoside-7-O-alpha-arabinopyranoside|quercetin 7-O-alpha-L-arabinopyranoside-3-O-(2-acetyl)-beta-D-galactopyranoside

quercetin 3-O-beta-(2-acetyl)galactopyranoside-7-O-alpha-arabinopyranoside|quercetin 7-O-alpha-L-arabinopyranoside-3-O-(2-acetyl)-beta-D-galactopyranoside

C28H30O17 (638.148293)


   
   

Deshydroxypentafuhalol

Deshydroxypentafuhalol

C30H22O16 (638.0907812)


   

Scutellarin-7-diglucosidic acid

beta-D-Glucopyranosiduronic acid, 5,6-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 2-O-beta-D-glucopyranuronosyl-

C27H26O18 (638.1119096)


   

Luteolin 7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide]

(2S,3S,4S,5R,6R)-6-(((2S,3R,4S,5S,6S)-6-Carboxy-2-((2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-yl)oxy)-4,5-dihydroxytetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid

C27H26O18 (638.1119096)


Luteolin-7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide] is the glycosyloxyflavone resulting from the condensation of the hydroxy group at position 7 of luteolin with the 1 position of 2-O-beta-D-glucopyranuronosyl-beta-D-glucopyranosiduronic acid. It is a trihydroxyflavone, a glycosyloxyflavone, a dicarboxylic acid, a disaccharide derivative and a luteolin O-glucuronoside. It is a conjugate acid of a luteolin 7-O-[(beta-D-glucosiduronate)-(1->2)-(beta-D-glucosiduronate)]. luteolin-7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide] is a natural product found in Elodea canadensis, Medicago truncatula, and other organisms with data available. This compound belongs to the family of Flavonoid O-Glycosides. These are compounds containing a carbohydrate moiety which is o-glycosidically linked to one of the flavonoid backbones (2-phenylchromen-4-one, 3-phenylchromen-4-one or 4-phenylcoumarin). The glycosyloxyflavone resulting from the condensation of the hydroxy group at position 7 of luteolin with the 1 position of 2-O-beta-D-glucopyranuronosyl-beta-D-glucopyranosiduronic acid. Luteolin 7-diglucuronide is the major flavonoid isolated from Aloysia triphylla and Verbena officinalis[1].

   

7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-hydroxy-6-(4-hydroxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one

NCGC00380486-01!7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-hydroxy-6-(4-hydroxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one

C28H30O17 (638.148293)


   

Flavone base + 4O, O-HexA-HexA

Flavone base + 4O, O-HexA-HexA

C27H26O18 (638.1119096)


Annotation level-3

   

Luteolin 7-glucuronosyl-(1->2)-glucuronide

Luteolin 7-glucuronosyl-(1->2)-glucuronide

C27H26O18 (638.1119096)


   

Luteolin 7,3-digalacturonide

Luteolin 7,3-digalacturonide

C27H26O18 (638.1119096)


   

Scutellarein 7-glucuronosyl-(1->2)-glucuronide

5-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-6-{[5,6-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-3,4-dihydroxyoxane-2-carboxylic acid

C27H26O18 (638.1119096)


   

Chesnatin

3-(6-{[(3,5-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methoxy]carbonyl}-2,3,4-trihydroxyphenoxy)-4,5-dihydroxybenzoic acid

C27H26O18 (638.1119096)


   

Luteolin 7-O-beta-D-diglucuronide

Luteolin 7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide]

C27H26O18 (638.1119096)


   

Bis(triphenylphosphine)dicarbonylnickel

Bis(triphenylphosphine)dicarbonylnickel

C38H30NiO2P2 (638.107441)


   

Thioproperazine dimesylate

Thioproperazine dimethanesulfonate

C24H38N4O8S4 (638.1572388)


C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent

   

disodium 5,5-[(1,4-dioxobut-2-ene-1,4-diyl)bis(imino-p-phenyleneazo)]disalicylate

disodium 5,5-[(1,4-dioxobut-2-ene-1,4-diyl)bis(imino-p-phenyleneazo)]disalicylate

C30H20N6Na2O8 (638.113796)


   

Etioporphyrin I dihydrobromide

Etioporphyrin I dihydrobromide

C32H40Br2N4 (638.161952)


   
   
   

Luteolin 7-O-diglucuronide

Luteolin 7-O-diglucuronide

C27H26O18 (638.1119096)


   

[5-[8-[5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl]-2-hydroxyphenyl] hydrogen sulate

[5-[8-[5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-3-yl]-5,7-dihydroxy-4-oxo-2,3-dihydrochromen-2-yl]-2-hydroxyphenyl] hydrogen sulate

C30H22O14S (638.0730232000001)


   

7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-hydroxy-6-(4-hydroxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one

7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-hydroxy-6-(4-hydroxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one

C28H30O17 (638.148293)


   

2-(5-{[(3,5-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methoxy]carbonyl}-2,3-dihydroxyphenoxy)-3,4,5-trihydroxybenzoic acid

2-(5-{[(3,5-dihydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methoxy]carbonyl}-2,3-dihydroxyphenoxy)-3,4,5-trihydroxybenzoic acid

C27H26O18 (638.1119096)


   

Luteolin 7,3'-digalacturonide

Luteolin 7,3'-digalacturonide

C27H26O18 (638.1119096)


   

methyl (1s,12s,13s,17r,28s,30r)-4-chloro-5,7,12,20,22,25-hexahydroxy-30-methyl-9,18,27-trioxo-14,29-dioxaoctacyclo[15.10.3.0¹,¹⁹.0³,¹⁶.0⁶,¹⁵.0⁸,¹³.0²¹,²⁶.0²⁸,³⁰]triaconta-3(16),4,6(15),7,19,21,23,25-octaene-13-carboxylate

methyl (1s,12s,13s,17r,28s,30r)-4-chloro-5,7,12,20,22,25-hexahydroxy-30-methyl-9,18,27-trioxo-14,29-dioxaoctacyclo[15.10.3.0¹,¹⁹.0³,¹⁶.0⁶,¹⁵.0⁸,¹³.0²¹,²⁶.0²⁸,³⁰]triaconta-3(16),4,6(15),7,19,21,23,25-octaene-13-carboxylate

C31H23ClO13 (638.0827138)


   

(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-{[3-hydroxy-2-(4-methoxyphenyl)-4-oxo-5-{[(2s,3r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-7-yl]oxy}oxane-2-carboxylic acid

(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-{[3-hydroxy-2-(4-methoxyphenyl)-4-oxo-5-{[(2s,3r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-7-yl]oxy}oxane-2-carboxylic acid

C28H30O17 (638.148293)


   

6-[(4,5-dihydroxy-2-{[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy}-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

6-[(4,5-dihydroxy-2-{[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy}-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C28H30O17 (638.148293)


   

methyl 4-chloro-5,7,12,20,22,25-hexahydroxy-30-methyl-9,18,27-trioxo-14,29-dioxaoctacyclo[15.10.3.0¹,¹⁹.0³,¹⁶.0⁶,¹⁵.0⁸,¹³.0²¹,²⁶.0²⁸,³⁰]triaconta-3(16),4,6(15),7,19,21,23,25-octaene-13-carboxylate

methyl 4-chloro-5,7,12,20,22,25-hexahydroxy-30-methyl-9,18,27-trioxo-14,29-dioxaoctacyclo[15.10.3.0¹,¹⁹.0³,¹⁶.0⁶,¹⁵.0⁸,¹³.0²¹,²⁶.0²⁸,³⁰]triaconta-3(16),4,6(15),7,19,21,23,25-octaene-13-carboxylate

C31H23ClO13 (638.0827138)


   

methyl 4-chloro-8,13,15,20,22,25-hexahydroxy-30-methyl-11,18,27-trioxo-6,29-dioxaoctacyclo[15.10.3.0¹,¹⁹.0³,¹⁶.0⁵,¹⁴.0⁷,¹².0²¹,²⁶.0²⁸,³⁰]triaconta-3(16),4,12,14,19,21,23,25-octaene-7-carboxylate

methyl 4-chloro-8,13,15,20,22,25-hexahydroxy-30-methyl-11,18,27-trioxo-6,29-dioxaoctacyclo[15.10.3.0¹,¹⁹.0³,¹⁶.0⁵,¹⁴.0⁷,¹².0²¹,²⁶.0²⁸,³⁰]triaconta-3(16),4,12,14,19,21,23,25-octaene-7-carboxylate

C31H23ClO13 (638.0827138)


   

2-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-7-[(3,4,5-trihydroxyoxan-2-yl)oxy]chromen-3-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl acetate

2-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-7-[(3,4,5-trihydroxyoxan-2-yl)oxy]chromen-3-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl acetate

C28H30O17 (638.148293)


   

2-[2',3',4,4',5,6-hexahydroxy-6'-(3,5,7-trihydroxy-4-oxo-2,3-dihydro-1-benzopyran-2-yl)-[1,1'-biphenyl]-2-yl]-3,5,7-trihydroxy-2,3-dihydro-1-benzopyran-4-one

2-[2',3',4,4',5,6-hexahydroxy-6'-(3,5,7-trihydroxy-4-oxo-2,3-dihydro-1-benzopyran-2-yl)-[1,1'-biphenyl]-2-yl]-3,5,7-trihydroxy-2,3-dihydro-1-benzopyran-4-one

C30H22O16 (638.0907812)


   

2-(4-{3-[2,6-dihydroxy-4-(2,4,6-trihydroxyphenoxy)phenoxy]-2,5-dihydroxyphenoxy}-3,5-dihydroxyphenoxy)benzene-1,3,5-triol

2-(4-{3-[2,6-dihydroxy-4-(2,4,6-trihydroxyphenoxy)phenoxy]-2,5-dihydroxyphenoxy}-3,5-dihydroxyphenoxy)benzene-1,3,5-triol

C30H22O16 (638.0907812)


   

(2s,3s,4s,5r,6s)-6-[4-(7-{[(2s,3r,4s,5s,6r)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-5-hydroxy-4-oxochromen-2-yl)-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

(2s,3s,4s,5r,6s)-6-[4-(7-{[(2s,3r,4s,5s,6r)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-5-hydroxy-4-oxochromen-2-yl)-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C27H26O18 (638.1119096)