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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP026017

(3S,5R,9R,10R,13S,14S,17S)-17-[(2S,3S,5S)-2-methoxy-5-(2-methylprop-1-enyl)oxolan-3-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

Formula: C31H50O3  |  Mol. Weight: 470.70 g/mol

IUPAC: (3S,5R,9R,10R,13S,14S,17S)-17-[(2S,3S,5S)-2-methoxy-5-(2-methylprop-1-enyl)oxolan-3-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

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Overview

Molecular Formula C31H50O3
Molecular Weight 470.70 g/mol
Canonical SMILES CC(=CC1CC(C(O1)OC)C2CCC3(C2(CCC4C3=CCC5C4(CCC(C5(C)C)O)C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy