BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP022844

Hexagalloylglucose

Formula: C48H36O30  |  Mol. Weight: 1092.80 g/mol

IUPAC: (2R,3S,4S,5S)-2,3,4,5,6-pentahydroxy-7-oxo-2,3,4,5,6-pentakis(3,4,5-trihydroxybenzoyl)-7-(3,4,5-trihydroxyphenyl)heptanal

3D View Find Similar

Overview

Molecular Formula C48H36O30
Molecular Weight 1092.80 g/mol
Canonical SMILES C1=C(C=C(C(=C1O)O)O)C(=O)C(C=O)(C(C(=O)C2=CC(=C(C(=C2)O)O)O)(C(C(=O)C3=CC(=C(C(=C3)O)O)O)(C(C(=O)C4=CC(=C(C(=C4)O)O)O)(C(C(=O)C5=CC(=C(C(=C5)O)O)O)(C(=O)C6=CC(=C(C(=C6)O)O)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy