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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP009572

(1S,3aS,8aS,9R,9aS)-9-hydroxy-1,5-dimethyl-8-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,3a,4,8a,9,9a-hexahydroazuleno[6,5-b]furan-2,6-dione

Formula: C21H28O10  |  Mol. Weight: 440.40 g/mol

IUPAC: (1S,3aS,8aS,9R,9aS)-9-hydroxy-1,5-dimethyl-8-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,3a,4,8a,9,9a-hexahydroazuleno[6,5-b]furan-2,6-dione

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Overview

Molecular Formula C21H28O10
Molecular Weight 440.40 g/mol
Canonical SMILES CC1C2C(CC(=C3C(C2O)C(=CC3=O)COC4C(C(C(C(O4)CO)O)O)O)C)OC1=O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy