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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP010840

(1S,3R,6S,7S,8S,11S,12S,15R,16R)-15-[(2R,4S,5S)-5-hydroperoxy-4-hydroxy-6-methylhept-6-en-2-yl]-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

Formula: C29H48O4  |  Mol. Weight: 460.70 g/mol

IUPAC: (1S,3R,6S,7S,8S,11S,12S,15R,16R)-15-[(2R,4S,5S)-5-hydroperoxy-4-hydroxy-6-methylhept-6-en-2-yl]-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol

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Overview

Molecular Formula C29H48O4
Molecular Weight 460.70 g/mol
Canonical SMILES CC1C2CCC3C4(CCC(C4(CCC35C2(C5)CCC1O)C)C(C)CC(C(C(=C)C)OO)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy