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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009052

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(5-hydroxy-4-oxochromen-7-yl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate

Formula: C22H20O13  |  Mol. Weight: 492.40 g/mol

IUPAC: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(5-hydroxy-4-oxochromen-7-yl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate

Overview

Molecular Formula C22H20O13
Molecular Weight 492.40 g/mol
Canonical SMILES C1=COC2=CC(=CC(=C2C1=O)O)OC3C(C(C(C(O3)COC(=O)C4=CC(=C(C(=C4)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy