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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP029764

[(3S,4S,5S,10S,13R,14R,17R)-4,10,13-trimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

Formula: C31H50O2  |  Mol. Weight: 454.70 g/mol

IUPAC: [(3S,4S,5S,10S,13R,14R,17R)-4,10,13-trimethyl-17-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate

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Overview

Molecular Formula C31H50O2
Molecular Weight 454.70 g/mol
Canonical SMILES CC1C2CCC3=C(C2(CCC1OC(=O)C)C)CCC4(C3CCC4C(C)CCC(=C)C(C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy