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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012522

(1S,3R,6S,8R,11S,12S,15R,16R)-15-[(E,2R)-6-hydroperoxy-6-methylhept-4-en-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

Formula: C30H50O3  |  Mol. Weight: 458.70 g/mol

IUPAC: (1S,3R,6S,8R,11S,12S,15R,16R)-15-[(E,2R)-6-hydroperoxy-6-methylhept-4-en-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

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Overview

Molecular Formula C30H50O3
Molecular Weight 458.70 g/mol
Canonical SMILES CC(CC=CC(C)(C)OO)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy