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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031538

(1S,4aS,10aR)-7-acetyl-1-(2-methoxy-2-oxoethyl)-4a-methyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid

Formula: C21H26O5  |  Mol. Weight: 358.40 g/mol

IUPAC: (1S,4aS,10aR)-7-acetyl-1-(2-methoxy-2-oxoethyl)-4a-methyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid

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Overview

Molecular Formula C21H26O5
Molecular Weight 358.40 g/mol
Canonical SMILES CC(=O)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(CC(=O)OC)C(=O)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy