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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP030909

[(3R,3aS,4S,8aR)-3-hydroxy-6,8a-dimethyl-1-oxo-3-propan-2-yl-3a,4,5,8-tetrahydro-2H-azulen-4-yl] 4-hydroxybenzoate

Formula: C22H28O5  |  Mol. Weight: 372.50 g/mol

IUPAC: [(3R,3aS,4S,8aR)-3-hydroxy-6,8a-dimethyl-1-oxo-3-propan-2-yl-3a,4,5,8-tetrahydro-2H-azulen-4-yl] 4-hydroxybenzoate

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Overview

Molecular Formula C22H28O5
Molecular Weight 372.50 g/mol
Canonical SMILES CC1=CCC2(C(C(C1)OC(=O)C3=CC=C(C=C3)O)C(CC2=O)(C(C)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy