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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038309

[(1Z,3S,3aS,5R,7S,7aS)-4-(azidomethyl)-1-ethylidene-4-hydroxy-3-(2-methylbutanoyloxy)-2-oxo-7-propan-2-yl-3,3a,5,6,7,7a-hexahydroinden-5-yl] (E)-3-methylpent-2-enoate

Formula: C26H39N3O6  |  Mol. Weight: 489.60 g/mol

IUPAC: [(1Z,3S,3aS,5R,7S,7aS)-4-(azidomethyl)-1-ethylidene-4-hydroxy-3-(2-methylbutanoyloxy)-2-oxo-7-propan-2-yl-3,3a,5,6,7,7a-hexahydroinden-5-yl] (E)-3-methylpent-2-enoate

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Overview

Molecular Formula C26H39N3O6
Molecular Weight 489.60 g/mol
Canonical SMILES CCC(C)C(=O)OC1C2C(C(CC(C2(CN=[N+]=[N-])O)OC(=O)C=C(C)CC)C(C)C)C(=CC)C1=O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy