BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012061

[(1R,3aR,5aR,5bR,7S,7aR,9S,11aR,11bR,13aR,13bR)-7-hydroxy-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-yl] octadecanoate

Formula: C48H84O3  |  Mol. Weight: 709.20 g/mol

IUPAC: [(1R,3aR,5aR,5bR,7S,7aR,9S,11aR,11bR,13aR,13bR)-7-hydroxy-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-yl] octadecanoate

Overview

Molecular Formula C48H84O3
Molecular Weight 709.20 g/mol
Canonical SMILES CCCCCCCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4C5C(CCC5(CCC4(C3(CC(C2C1(C)C)O)C)C)C)C(=C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy