BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005808

[(3R,8S,9S,10R,13R,14S,17R)-17-[(2R)-7-hydroxy-6-methylheptan-2-yl]-4,4,10,13,14-pentamethyl-2,3,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] (Z)-hexadec-9-enoate

Formula: C46H80O3  |  Mol. Weight: 681.10 g/mol

IUPAC: [(3R,8S,9S,10R,13R,14S,17R)-17-[(2R)-7-hydroxy-6-methylheptan-2-yl]-4,4,10,13,14-pentamethyl-2,3,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl] (Z)-hexadec-9-enoate

3D View Find Similar

Overview

Molecular Formula C46H80O3
Molecular Weight 681.10 g/mol
Canonical SMILES CCCCCCC=CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(CCC4(C3CC=C2C1(C)C)C)C(C)CCCC(C)CO)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy