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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP032758

galloyl(-6)Glc(b)-O-coumaroyl

Formula: C22H22O12  |  Mol. Weight: 478.40 g/mol

IUPAC: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate

Overview

Molecular Formula C22H22O12
Molecular Weight 478.40 g/mol
Canonical SMILES C1=CC(=CC=C1C=CC(=O)OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy