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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP025620

(2S,4aS,6aR,10S,10aS,10bS)-2-(furan-3-yl)-4a-hydroxy-6a,10b-dimethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,5,6,10,10a-hexahydrobenzo[f]isochromene-4,7-dione

Formula: C25H32O11  |  Mol. Weight: 508.50 g/mol

IUPAC: (2S,4aS,6aR,10S,10aS,10bS)-2-(furan-3-yl)-4a-hydroxy-6a,10b-dimethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,5,6,10,10a-hexahydrobenzo[f]isochromene-4,7-dione

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Overview

Molecular Formula C25H32O11
Molecular Weight 508.50 g/mol
Canonical SMILES CC12CCC3(C(=O)OC(CC3(C1C(C=CC2=O)OC4C(C(C(C(O4)CO)O)O)O)C)C5=COC=C5)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy