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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP018048

7-[(E,4R,6R)-4,7-dihydroxy-3,7-dimethyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoct-2-enoxy]chromen-2-one

Formula: C25H34O11  |  Mol. Weight: 510.50 g/mol

IUPAC: 7-[(E,4R,6R)-4,7-dihydroxy-3,7-dimethyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoct-2-enoxy]chromen-2-one

Overview

Molecular Formula C25H34O11
Molecular Weight 510.50 g/mol
Canonical SMILES CC(=CCOC1=CC2=C(C=C1)C=CC(=O)O2)C(CC(C(C)(C)O)OC3C(C(C(C(O3)CO)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy