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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031196

4-[(1R)-1-[(2S)-5,7-dihydroxy-8-methyl-4-oxo-2-phenyl-2,3-dihydrochromen-6-yl]-3-methylbutyl]-5-hydroxy-2,2,6,6-tetramethylcyclohex-4-ene-1,3-dione

Formula: C31H36O7  |  Mol. Weight: 520.60 g/mol

IUPAC: 4-[(1R)-1-[(2S)-5,7-dihydroxy-8-methyl-4-oxo-2-phenyl-2,3-dihydrochromen-6-yl]-3-methylbutyl]-5-hydroxy-2,2,6,6-tetramethylcyclohex-4-ene-1,3-dione

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Overview

Molecular Formula C31H36O7
Molecular Weight 520.60 g/mol
Canonical SMILES CC1=C(C(=C(C2=C1OC(CC2=O)C3=CC=CC=C3)O)C(CC(C)C)C4=C(C(C(=O)C(C4=O)(C)C)(C)C)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy