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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP026910

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

Formula: C46H78O3  |  Mol. Weight: 679.10 g/mol

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

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Overview

Molecular Formula C46H78O3
Molecular Weight 679.10 g/mol
Canonical SMILES CCCCCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4C5C(=CCC5(C(CC4(C3(CCC2C1(C)C)C)C)O)C)C(=C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy