Exact Mass: 442.09

Exact Mass Matches: 442.09

Found 61 metabolites which its exact mass value is equals to given mass value 442.09, within given mass tolerance error 8.0E-6 dalton. Try search metabolite list with more accurate mass tolerance error 1.6E-6 dalton.

(-)-Epicatechin 3-O-gallate

Benzoic acid, 3,4,5-trihydroxy-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-cis)-

C22H18O10 (442.09)


(-)-epicatechin-3-O-gallate is a gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of epicatechin. A natural product found in Parapiptadenia rigida. It has a role as a metabolite, an EC 3.2.1.1 (alpha-amylase) inhibitor and an EC 3.2.1.20 (alpha-glucosidase) inhibitor. It is a catechin, a gallate ester and a polyphenol. It is functionally related to a (-)-epicatechin and a gallic acid. (-)-Epicatechin gallate is a natural product found in Scurrula atropurpurea, Acacia omalophylla, and other organisms with data available. Isolated from tea and numerous other plant subspecies inc. rhubarb and grapes. Epicatechin 3-gallate is found in many foods, some of which are cucumber, muskmelon, black raspberry, and cashew nut. A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of epicatechin. A natural product found in Parapiptadenia rigida. (-)-Epicatechin 3-O-gallate is found in almond. (-)-Epicatechin 3-O-gallate is isolated from tea and numerous other plant species including rhubarb and grapes. D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

(-)-Catechin 3-O-gallate

Benzoic acid, 3,4,5-trihydroxy-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2S-trans)-

C22H18O10 (442.09)


(-)-catechin-3-O-gallate is a gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of (-)-catechin. It has a role as a metabolite. It is a gallate ester, a polyphenol and a member of flavans. It is functionally related to a (-)-catechin and a gallic acid. It is an enantiomer of a (+)-catechin-3-O-gallate. (-)-Catechin gallate is a natural product found in Rheum palmatum, Vitis vinifera, and other organisms with data available. A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of (-)-catechin. (-)-Catechin 3-O-gallate is a polyphenol compound found in foods of plant origin (PMID: 20428313) (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes.

   

7-Galloylcatechin

2-(3,4-Dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-1-benzopyran-7-yl 3,4,5-trihydroxybenzoic acid

C22H18O10 (442.09)


7-Galloylcatechin is found in herbs and spices. 7-Galloylcatechin is isolated from roots of great burnet (Sanguisorba officinalis). Isolated from roots of great burnet (Sanguisorba officinalis). Catechin 7-gallate is found in tea and herbs and spices.

   

[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-5-yl] 3,4,5-trihydroxybenzoate

[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-5-yl] 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)


   

3-Galloylcatechin

2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoic acid

C22H18O10 (442.09)


Constituent of Bergenia crassifolia (Siberian tea). Catechin 3-gallate is found in many foods, some of which are macadamia nut (m. tetraphylla), tea, avocado, and pecan nut. 3-Galloylcatechin is found in almond. 3-Galloylcatechin is a constituent of Bergenia crassifolia (Siberian tea) (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

Epicatechin-3-gallate

(2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)


   

Arteminorin A

Arteminorin A

C22H18O10 (442.09)


   

4,4-Biisofraxidin

4,4-Biisofraxidin

C22H18O10 (442.09)


   

ent-Epicatechin 3-O-gallate

(2S,3S) -3,5,7,3,4-Pentahydroxyflavan 3-O-gallate

C22H18O10 (442.09)


   

Epicatechin-3-gallate

(2S,3S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)


(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

Robinetinidol 3-O-gallate

(2R,3S) -3,7,3,4,5-Pentahydroxyflavan 3-O-gallate

C22H18O10 (442.09)


   

ent-Robinetinidol 3-O-gallate

ent-Robinetinidol 3-O-gallate

C22H18O10 (442.09)


   

(-)-Catechin gallate

3,4,5-Trihydroxybenzoic acid [ [ (2S) -2beta- (3,4-dihydroxyphenyl) -3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran ] -3alpha-yl ] ester

C22H18O10 (442.09)


(-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes.

   

Catechin 4-O-gallate

(2R,3S) -3,5,7,3,4-Pentahydroxyflavan 4-O-gallate

C22H18O10 (442.09)


   

Catechin 7-O-gallate

(2R,3S) -3,5,7,3,4-Pentahydroxyflavan 7-O-gallate

C22H18O10 (442.09)


   

(+)-Catechin 4-O-gallate|4-O-(3,4,5-Trihydroxybenzoyl)-(2R,3S)-3,3,4,5,7-Pentahydroxyflavan

(+)-Catechin 4-O-gallate|4-O-(3,4,5-Trihydroxybenzoyl)-(2R,3S)-3,3,4,5,7-Pentahydroxyflavan

C22H18O10 (442.09)


   

SCHEMBL18393487

SCHEMBL18393487

C22H18O10 (442.09)


   

Galloylrobidanol

Galloylrobidanol

C22H18O10 (442.09)


   

3-O-galloyl-(-)-epicatechin

3-O-galloyl-(-)-epicatechin

C22H18O10 (442.09)


   

J3.570.538D

J3.570.538D

C22H18O10 (442.09)


   

7-O-Galloyltricetiflavan

7-O-Galloyltricetiflavan

C22H18O10 (442.09)


A gallate ester obtained by the formal condensation of gallic acid with the hydroxy group at position 7 of 3,4,5,5,7-pentahydroxyflavan. Isolated from the leaves of Pithecellobium clypearia, it exhibits antiviral activity.

   
   

catechin gallate

(-)-Catechin gallate

C22H18O10 (442.09)


(-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes.

   

[(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate

NCGC00179135-03![(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)


   

[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate

NCGC00385833-01![(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)


   

(-)-Epicatechin gallate

(-)-Epicatechin-3-O-gallate

C22H18O10 (442.09)


(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

EPICATECHIN 3-O-GALLATE

EPICATECHIN 3-O-GALLATE

C22H18O10 (442.09)


   

epicatechin-3-O-gallate

epicatechin-3-O-gallate

C22H18O10 (442.09)


   

Epicatechingallate

Epicatechingallate

C22H18O10 (442.09)


   

epicatechin gallate

epicatechin gallate

C22H18O10 (442.09)


(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate

[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)


   

epicatechin monogallate

epicatechin monogallate

C22H18O10 (442.09)


(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate [IIN-based on: CCMSLIB00000848607]

NCGC00385833-01![(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate [IIN-based on: CCMSLIB00000848607]

C22H18O10 (442.09)


   

[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate [IIN-based: Match]

NCGC00385833-01![(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate [IIN-based: Match]

C22H18O10 (442.09)


   

Catechin 3-O-gallate

Catechin 3-O-gallate

C22H18O10 (442.09)


   

(-)-Epicatechin 3-O-gallate

(-)-Epicatechin 3-O-gallate

C22H18O10 (442.09)


   

Catechin 5-O-gallate

Catechin 5-O-gallate

C22H18O10 (442.09)


   

Icosyl palmitate

2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-1-benzopyran-7-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)


   

(-)-Epicatechin-5-gallate

(-)-Epicatechin-5-gallate

C22H18O10 (442.09)


A gallate ester resulting from the formal condensation of gallic acid with 5-hydroxy group of (-)-epicatechin. Isolated from Orostachys japonica, it acts as an inhibitor of the enzyme mu-calpain (EC 3.4.22.52).

   

863-03-6

Benzoic acid, 3,4,5-trihydroxy-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, cis-

C22H18O10 (442.09)


D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

E3893_SIAL

Benzoic acid, 3,4,5-trihydroxy-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-cis)-

C22H18O10 (442.09)


D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.

   

(+)-Catechin gallate

(+)-Catechin gallate

C22H18O10 (442.09)


   

(-)-epicatechingallate

(-)-epicatechingallate

C22H18O10 (442.09)


   

epicatechin-3-gallate

epicatechin-3-gallate

C22H18O10 (442.09)


D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents

   

7-Galloylcatechin

7-Galloylcatechin

C22H18O10 (442.09)


   

(+)-epicatechin-3-O-gallate

(+)-epicatechin-3-O-gallate

C22H18O10 (442.09)


A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3S)-hydroxy group of (+)-epicatechin.

   

(+)-catechin-3-O-gallate

(+)-catechin-3-O-gallate

C22H18O10 (442.09)


A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3S)-hydroxy group of (+)-catechin.

   

3- o -galloyl- ent -catechin

NA

C22H18O10 (442.09)


{"Ingredient_id": "HBIN009326","Ingredient_name": "3- o -galloyl- ent -catechin","Alias": "NA","Ingredient_formula": "C22H18O10","Ingredient_Smile": "NA","Ingredient_weight": "442.378","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8512","PubChem_id": "NA","DrugBank_id": "NA"}

   

(2s,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl 2,3,4-trihydroxybenzoate

(2s,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl 2,3,4-trihydroxybenzoate

C22H18O10 (442.09)


   

7,7'-dihydroxy-6,6',8,8'-tetramethoxy-[4,4'-bichromene]-2,2'-dione

7,7'-dihydroxy-6,6',8,8'-tetramethoxy-[4,4'-bichromene]-2,2'-dione

C22H18O10 (442.09)


   

catechin 4'-o-gallate

catechin 4'-o-gallate

C22H18O10 (442.09)


   

(2r)-5-hydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-7-yl 3,4,5-trihydroxybenzoate

(2r)-5-hydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-7-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)


   

2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-5-yl 3,4,5-trihydroxybenzoate

2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-5-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)


   

(2s)-5-hydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-7-yl 3,4,5-trihydroxybenzoate

(2s)-5-hydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-7-yl 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)


   

2-hydroxy-4-(3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl 3,4,5-trihydroxybenzoate

2-hydroxy-4-(3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)


   

6,6',8,8'-tetrahydroxy-7,7'-dimethoxy-3,3'-dimethyl-[5,5'-biisochromene]-1,1'-dione

6,6',8,8'-tetrahydroxy-7,7'-dimethoxy-3,3'-dimethyl-[5,5'-biisochromene]-1,1'-dione

C22H18O10 (442.09)


   

3-[(6,8-dimethoxy-2-oxochromen-7-yl)oxy]-7-hydroxy-6,8-dimethoxychromen-2-one

3-[(6,8-dimethoxy-2-oxochromen-7-yl)oxy]-7-hydroxy-6,8-dimethoxychromen-2-one

C22H18O10 (442.09)


   

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl 2,3,4-trihydroxybenzoate

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl 2,3,4-trihydroxybenzoate

C22H18O10 (442.09)


   

2,7-dihydroxy-1-methoxy-4,6,11-trioxo-3-propanoyl-4a,12-dihydro-1h-5-oxatetracene-12a-carboxylic acid

2,7-dihydroxy-1-methoxy-4,6,11-trioxo-3-propanoyl-4a,12-dihydro-1h-5-oxatetracene-12a-carboxylic acid

C22H18O10 (442.09)


   

catechin 3'-o-gallate

catechin 3'-o-gallate

C22H18O10 (442.09)


   

2-hydroxy-5-(3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl 3,4,5-trihydroxybenzoate

2-hydroxy-5-(3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)phenyl 3,4,5-trihydroxybenzoate

C22H18O10 (442.09)