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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP027210

7-Hydroxy-4-(4-hydroxy-3-methoxyphenyl)-5-[2-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]ethenyl]-3,4-dihydrochromen-2-one

Formula: C31H32O12  |  Mol. Weight: 596.60 g/mol

IUPAC: 7-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-5-[2-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]ethenyl]-3,4-dihydrochromen-2-one

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Overview

Molecular Formula C31H32O12
Molecular Weight 596.60 g/mol
Canonical SMILES COC1=C(C=CC(=C1)C=CC2=C3C(CC(=O)OC3=CC(=C2)O)C4=CC(=C(C=C4)O)OC)OC5C(C(C(C(O5)CO)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy