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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013813

[(2R,3R,4aR,5S,8aR)-3-hydroxy-1,1,4a-trimethyl-6-methylidene-5-[(2E)-3-methylpenta-2,4-dienyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl] acetate

Formula: C22H34O3  |  Mol. Weight: 346.50 g/mol

IUPAC: [(2R,3R,4aR,5S,8aR)-3-hydroxy-1,1,4a-trimethyl-6-methylidene-5-[(2E)-3-methylpenta-2,4-dienyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-yl] acetate

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Overview

Molecular Formula C22H34O3
Molecular Weight 346.50 g/mol
Canonical SMILES CC(=CCC1C(=C)CCC2C1(CC(C(C2(C)C)OC(=O)C)O)C)C=C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy