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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP035212

(4S)-7-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-5-[(E)-2-(4-hydroxyphenyl)ethenyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydrochromen-2-one

Formula: C30H30O12  |  Mol. Weight: 582.60 g/mol

IUPAC: (4S)-7-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-5-[(E)-2-(4-hydroxyphenyl)ethenyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydrochromen-2-one

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Overview

Molecular Formula C30H30O12
Molecular Weight 582.60 g/mol
Canonical SMILES COC1=C(C=CC(=C1)C2CC(=O)OC3=C2C(=C(C(=C3)O)OC4C(C(C(C(O4)CO)O)O)O)C=CC5=CC=C(C=C5)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy