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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031149

(3S)-7-[(E)-2-[3-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,5-dihydroxyphenyl]ethenyl]-2,2-dimethyl-3,4-dihydrochromene-3,5-diol

Formula: C29H36O5  |  Mol. Weight: 464.60 g/mol

IUPAC: (3S)-7-[(E)-2-[3-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,5-dihydroxyphenyl]ethenyl]-2,2-dimethyl-3,4-dihydrochromene-3,5-diol

Overview

Molecular Formula C29H36O5
Molecular Weight 464.60 g/mol
Canonical SMILES CC(=CCCC(=CCC1=C(C(=CC(=C1)C=CC2=CC(=C3CC(C(OC3=C2)(C)C)O)O)O)O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy