BIMP Logo
SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP008992

3-[(2R,3R,4S,5S,6R)-2-(2-carboxyacetyl)oxy-5-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3-oxopropanoic acid

Formula: C27H25O17+  |  Mol. Weight: 621.50 g/mol

IUPAC: 3-[(2R,3R,4S,5S,6R)-2-(2-carboxyacetyl)oxy-5-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3-oxopropanoic acid

3D View Find Similar

Overview

Molecular Formula C27H25O17+
Molecular Weight 621.50 g/mol
Canonical SMILES C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(OC(C(C4O)OC(=O)CC(=O)O)OC(=O)CC(=O)O)CO)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy