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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009248

(2R,3R)-2-[3-[5-[(3S,3aR,6S,6aR)-3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-hydroxy-3-methoxyphenyl]-4,5-dihydroxyphenyl]-3,5,7-trihydroxy-2,3-dihydrochromen-4-one

Formula: C35H32O13  |  Mol. Weight: 660.60 g/mol

IUPAC: (2R,3R)-2-[3-[5-[(3S,3aR,6S,6aR)-3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-hydroxy-3-methoxyphenyl]-4,5-dihydroxyphenyl]-3,5,7-trihydroxy-2,3-dihydrochromen-4-one

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Overview

Molecular Formula C35H32O13
Molecular Weight 660.60 g/mol
Canonical SMILES COC1=CC(=CC(=C1O)C2=C(C(=CC(=C2)C3C(C(=O)C4=C(C=C(C=C4O3)O)O)O)O)O)C5C6COC(C6CO5)C7=CC(=C(C=C7)O)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy