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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP017166

[(3S,5R,8R,9S,10R,13R,14S,17S)-17-[(2R)-2-hydroxy-6-methylhept-6-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hexadecanoate

Formula: C46H82O3  |  Mol. Weight: 683.10 g/mol

IUPAC: [(3S,5R,8R,9S,10R,13R,14S,17S)-17-[(2R)-2-hydroxy-6-methylhept-6-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hexadecanoate

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Overview

Molecular Formula C46H82O3
Molecular Weight 683.10 g/mol
Canonical SMILES CCCCCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(CCC4(C3CCC2C1(C)C)C)C(C)(CCCC(=C)C)O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy