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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP018510

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-hydroxy-2-[(2S)-5-hydroxy-7,8-dimethoxy-4-oxo-2,3-dihydrochromen-2-yl]phenoxy]oxan-2-yl]methyl acetate

Formula: C25H28O13  |  Mol. Weight: 536.50 g/mol

IUPAC: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-hydroxy-2-[(2S)-5-hydroxy-7,8-dimethoxy-4-oxo-2,3-dihydrochromen-2-yl]phenoxy]oxan-2-yl]methyl acetate

Overview

Molecular Formula C25H28O13
Molecular Weight 536.50 g/mol
Canonical SMILES CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C(C=C2)O)C3CC(=O)C4=C(O3)C(=C(C=C4O)OC)OC)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy