Epigallocatechin 3-O-(3-O-Methyl)-Gallate

Datasheet MSDS
Catalog Number
ANC01006
Product Name
Epigallocatechin 3-O-(3-O-Methyl)-Gallate
Structure
Epigallocatechin 3-O-(3-O-Methyl)-Gallate
CAS Number
83104-87-4
IUPAC Name
[(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4-dihydroxy-5-methoxybenzoate
Synonyms
Epigallocatechin3-O-(3-O-methyl)gallate; [(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl]3,4-dihydroxy-5-methoxybenzoate
Molecular Formula
C23H20O11
Molecular Weight
472.402
Purity
>98%
Solubility
Soluble in DMSO
SMILES
COC1=CC(=CC(=C1O)O)C(=O)O[C@@H]2CC3=C(C=C(C=C3O[C@@H]2C4=CC(=C(C(=C4)O)O)O)O)O
InChI
InChI=1S/C23H20O11/c1-32-18-5-10(4-16(28)21(18)30)23(31)34-19-8-12-13(25)6-11(24)7-17(12)33-22(19)9-2-14(26)20(29)15(27)3-9/h2-7,19,22,24-30H,8H2,1H3/t19-,22-/m1/s1
InChI Key
WVRDOLPMKOCJRJ-DENIHFKCSA-N
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