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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005206

[(2R,3S,4S,5R,6S)-6-(4-benzoyl-3,5-dihydroxy-2,6-dimethylphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate

Formula: C28H28O13  |  Mol. Weight: 572.50 g/mol

IUPAC: [(2R,3S,4S,5R,6S)-6-(4-benzoyl-3,5-dihydroxy-2,6-dimethylphenoxy)-3,4,5-trihydroxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate

Overview

Molecular Formula C28H28O13
Molecular Weight 572.50 g/mol
Canonical SMILES CC1=C(C(=C(C(=C1OC2C(C(C(C(O2)COC(=O)C3=CC(=C(C(=C3)O)O)O)O)O)O)C)O)C(=O)C4=CC=CC=C4)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy