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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP001853

3-[[(2R,3S,4S,5R,6S)-6-[4-(5,7-dihydroxy-4-oxochromen-3-yl)phenoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid

Formula: C24H22O13  |  Mol. Weight: 518.40 g/mol

IUPAC: 3-[[(2R,3S,4S,5R,6S)-6-[4-(5,7-dihydroxy-4-oxochromen-3-yl)phenoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid

Overview

Molecular Formula C24H22O13
Molecular Weight 518.40 g/mol
Canonical SMILES C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)OC4C(C(C(C(O4)COC(=O)CC(=O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy