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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP029985

Isocaespitol

Formula: C15H25Br2ClO2  |  Mol. Weight: 432.60 g/mol

IUPAC: (2R,3R,5R)-5-bromo-2-[(1S,3R,4R)-4-bromo-3-chloro-4-methylcyclohexyl]-2,6,6-trimethyloxan-3-ol

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Overview

Molecular Formula C15H25Br2ClO2
Molecular Weight 432.60 g/mol
Canonical SMILES CC1(C(CC(C(O1)(C)C2CCC(C(C2)Cl)(C)Br)O)Br)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy