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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H20O11
Molecular Weight 472.3992
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4''-METHYLEPIGALLOCATECHIN GALLATE

SMILES

COc1c(cc(cc1O)C(=O)O[C@]2([H])Cc3c(cc(cc3O[C@]2([H])c4cc(c(c(c4)O)O)O)O)O)O

InChI

InChIKey=BMJHAAZDURGGSC-TZIWHRDSSA-N
InChI=1S/C23H20O11/c1-32-22-16(28)4-10(5-17(22)29)23(31)34-19-8-12-13(25)6-11(24)7-18(12)33-21(19)9-2-14(26)20(30)15(27)3-9/h2-7,19,21,24-30H,8H2,1H3/t19-,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H20O11
Molecular Weight 472.3992
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 15:35:50 UTC 2021
Edited
by admin
on Sat Jun 26 15:35:50 UTC 2021
Record UNII
CUX41G3911
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4''-METHYLEPIGALLOCATECHIN GALLATE
Common Name English
4''-O-METHYL-(-)-EPIGALLOCATECHIN-3-O-GALLATE
Common Name English
EGCG4''ME
Common Name English
(-)-EPIGALLOCATECHIN 3-(4''-O-METHYL) GALLATE
Common Name English
EPIGALLOCATECHIN-3-O-(4-O-METHYL)GALLATE
Common Name English
BENZOIC ACID, 3,5-DIHYDROXY-4-METHOXY-, (2R,3R)-3,4-DIHYDRO-5,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-2H-1-BENZOPYRAN-3-YL ESTER
Common Name English
Code System Code Type Description
PUBCHEM
401129
Created by admin on Sat Jun 26 15:35:50 UTC 2021 , Edited by admin on Sat Jun 26 15:35:50 UTC 2021
PRIMARY
CAS
224434-07-5
Created by admin on Sat Jun 26 15:35:50 UTC 2021 , Edited by admin on Sat Jun 26 15:35:50 UTC 2021
PRIMARY
FDA UNII
CUX41G3911
Created by admin on Sat Jun 26 15:35:50 UTC 2021 , Edited by admin on Sat Jun 26 15:35:50 UTC 2021
PRIMARY
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