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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP025547

3-[[(1S,4S,6S,8aS)-4,8a-dimethyl-6-prop-1-en-2-yl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl]-2,4,6-trihydroxy-5-(3-methylbutanoyl)benzaldehyde

Formula: C28H38O5  |  Mol. Weight: 454.60 g/mol

IUPAC: 3-[[(1S,4S,6S,8aS)-4,8a-dimethyl-6-prop-1-en-2-yl-2,3,4,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl]-2,4,6-trihydroxy-5-(3-methylbutanoyl)benzaldehyde

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Overview

Molecular Formula C28H38O5
Molecular Weight 454.60 g/mol
Canonical SMILES CC1CCC(C2(C1=CC(CC2)C(=C)C)C)CC3=C(C(=C(C(=C3O)C(=O)CC(C)C)O)C=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy