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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP003153

(4S,4aR,4bS,5S,7R,8aS,10S,10aS)-4,5,10-trihydroxy-1,1-dimethyl-9-oxo-7-(3-oxoprop-1-en-2-yl)-3,4,4b,5,6,7,8,8a,10,10a-decahydro-2H-phenanthrene-4a-carbaldehyde

Formula: C20H28O6  |  Mol. Weight: 364.40 g/mol

IUPAC: (4S,4aR,4bS,5S,7R,8aS,10S,10aS)-4,5,10-trihydroxy-1,1-dimethyl-9-oxo-7-(3-oxoprop-1-en-2-yl)-3,4,4b,5,6,7,8,8a,10,10a-decahydro-2H-phenanthrene-4a-carbaldehyde

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Overview

Molecular Formula C20H28O6
Molecular Weight 364.40 g/mol
Canonical SMILES CC1(CCC(C2(C1C(C(=O)C3C2C(CC(C3)C(=C)C=O)O)O)C=O)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy