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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP026023

ethyl 3-[(3S,3aS,5aR,6R,7R,9bS)-3-[(E,2S)-7-hydroxy-6-methylhept-5-en-2-yl]-7-(2-hydroxypropan-2-yl)-3a,6,9b-trimethyl-1,2,3,4,5,5a,7,8-octahydrocyclopenta[a]naphthalen-6-yl]propanoate

Formula: C32H54O4  |  Mol. Weight: 502.80 g/mol

IUPAC: ethyl 3-[(3S,3aS,5aR,6R,7R,9bS)-3-[(E,2S)-7-hydroxy-6-methylhept-5-en-2-yl]-7-(2-hydroxypropan-2-yl)-3a,6,9b-trimethyl-1,2,3,4,5,5a,7,8-octahydrocyclopenta[a]naphthalen-6-yl]propanoate

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Overview

Molecular Formula C32H54O4
Molecular Weight 502.80 g/mol
Canonical SMILES CCOC(=O)CCC1(C2CCC3(C(CCC3(C2=CCC1C(C)(C)O)C)C(C)CCC=C(C)CO)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy