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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP035736

2-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxan-2-yl]oxybenzoic acid

Formula: C20H20O13  |  Mol. Weight: 468.40 g/mol

IUPAC: 2-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[(3,4,5-trihydroxybenzoyl)oxymethyl]oxan-2-yl]oxybenzoic acid

Overview

Molecular Formula C20H20O13
Molecular Weight 468.40 g/mol
Canonical SMILES C1=CC(=C(C=C1OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O)C(=O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy