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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP004065

(3aS,6R,6aS,8R,9aR,9bR)-6-hydroxy-6-methyl-3,9-dimethylidene-8-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one

Formula: C21H30O9  |  Mol. Weight: 426.50 g/mol

IUPAC: (3aS,6R,6aS,8R,9aR,9bR)-6-hydroxy-6-methyl-3,9-dimethylidene-8-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-2-one

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Overview

Molecular Formula C21H30O9
Molecular Weight 426.50 g/mol
Canonical SMILES CC1(CCC2C(C3C1CC(C3=C)OC4C(C(C(C(O4)CO)O)O)O)OC(=O)C2=C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy