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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP014787

Iso-dulcinol

Formula: C27H36O4  |  Mol. Weight: 424.60 g/mol

IUPAC: [(1S,2S,5S,7R,8R,10S,13R)-5-hydroxy-2,6,6,13-tetramethyl-12-oxo-8-tetracyclo[11.2.1.01,10.02,7]hexadecanyl] benzoate

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Overview

Molecular Formula C27H36O4
Molecular Weight 424.60 g/mol
Canonical SMILES CC1(C(CCC2(C1C(CC3C24CCC(C4)(C(=O)C3)C)OC(=O)C5=CC=CC=C5)C)O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy