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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP017117

(3S,4aS,10aS)-3-(Acetyloxy)-2,3,4,4a,10,10a-hexahydro-6-hydroxy-1,1,4a-trimethyl-7-(1-methylethyl)-9(1H)-phenanthrenone

Formula: C22H30O4  |  Mol. Weight: 358.50 g/mol

IUPAC: [(3S,4aS,10aS)-6-hydroxy-1,1,4a-trimethyl-9-oxo-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthren-3-yl] acetate

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Overview

Molecular Formula C22H30O4
Molecular Weight 358.50 g/mol
Canonical SMILES CC(C)C1=C(C=C2C(=C1)C(=O)CC3C2(CC(CC3(C)C)OC(=O)C)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy