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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007008

(E)-1-[2,4-dihydroxy-3-[(2R,3S,4R,6S)-3-hydroxy-2-(4-hydroxyphenyl)-6-[2-(4-hydroxyphenyl)ethyl]oxan-4-yl]-6-methoxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one

Formula: C35H34O9  |  Mol. Weight: 598.60 g/mol

IUPAC: (E)-1-[2,4-dihydroxy-3-[(2R,3S,4R,6S)-3-hydroxy-2-(4-hydroxyphenyl)-6-[2-(4-hydroxyphenyl)ethyl]oxan-4-yl]-6-methoxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one

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Overview

Molecular Formula C35H34O9
Molecular Weight 598.60 g/mol
Canonical SMILES COC1=C(C(=C(C(=C1)O)C2CC(OC(C2O)C3=CC=C(C=C3)O)CCC4=CC=C(C=C4)O)O)C(=O)C=CC5=CC=C(C=C5)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy