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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP025482

1-[(3S,5R,8S,9S,10R,13S,14S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-10,13-dimethyl-4-oxo-1,2,3,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]-3-propan-2-ylideneazetidin-2-one

Formula: C29H46N2O2  |  Mol. Weight: 454.70 g/mol

IUPAC: 1-[(3S,5R,8S,9S,10R,13S,14S,17S)-17-[(1S)-1-(dimethylamino)ethyl]-10,13-dimethyl-4-oxo-1,2,3,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]-3-propan-2-ylideneazetidin-2-one

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Overview

Molecular Formula C29H46N2O2
Molecular Weight 454.70 g/mol
Canonical SMILES CC(C1CCC2C1(CCC3C2CCC4C3(CCC(C4=O)N5CC(=C(C)C)C5=O)C)C)N(C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy