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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009126

[(1aS,2aR,5R,5aS,6S,7aR)-5-hydroxy-2a,7a-dimethyl-5-propan-2-yl-2,3,4,5a,6,7-hexahydro-1aH-azuleno[6,7-b]oxiren-6-yl] 4-hydroxybenzoate

Formula: C22H30O5  |  Mol. Weight: 374.50 g/mol

IUPAC: [(1aS,2aR,5R,5aS,6S,7aR)-5-hydroxy-2a,7a-dimethyl-5-propan-2-yl-2,3,4,5a,6,7-hexahydro-1aH-azuleno[6,7-b]oxiren-6-yl] 4-hydroxybenzoate

Overview

Molecular Formula C22H30O5
Molecular Weight 374.50 g/mol
Canonical SMILES CC(C)C1(CCC2(C1C(CC3(C(C2)O3)C)OC(=O)C4=CC=C(C=C4)O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy