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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038129

Azedarachol

Formula: C25H40O5  |  Mol. Weight: 420.60 g/mol

IUPAC: [(1R)-1-[(2R,3S,5S,8R,9S,10S,13S,14S,16S,17R)-2,3,16-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethyl] 2-methylprop-2-enoate

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Overview

Molecular Formula C25H40O5
Molecular Weight 420.60 g/mol
Canonical SMILES CC(C1C(CC2C1(CCC3C2CCC4C3(CC(C(C4)O)O)C)C)O)OC(=O)C(=C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy