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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013416

(1S,4S,6S,9R,10R,13S,14S,17S)-9-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,14-dimethyl-5,19,20-trioxahexacyclo[11.5.2.01,14.04,6.04,13.06,10]icos-2-en-17-ol

Formula: C28H42O4  |  Mol. Weight: 442.60 g/mol

IUPAC: (1S,4S,6S,9R,10R,13S,14S,17S)-9-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,14-dimethyl-5,19,20-trioxahexacyclo[11.5.2.01,14.04,6.04,13.06,10]icos-2-en-17-ol

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Overview

Molecular Formula C28H42O4
Molecular Weight 442.60 g/mol
Canonical SMILES CC(C)C(C)C=CC(C)C1CCC23C1(CCC45C2(O3)C=CC6(C4(CCC(C6)O)C)OO5)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy