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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009546

(E)-4-[(1R,3S,4aR,5R,8aS)-3-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one

Formula: C18H28O3  |  Mol. Weight: 292.40 g/mol

IUPAC: (E)-4-[(1R,3S,4aR,5R,8aS)-3-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one

Overview

Molecular Formula C18H28O3
Molecular Weight 292.40 g/mol
Canonical SMILES CC(=O)C=CC1C(=C)C(CC2C1(CCCC2(C)CO)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy