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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP018128

11-hydroxy-4-oxo-8-phenyl-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-2-carboxylic acid

Formula: C25H22O11  |  Mol. Weight: 498.40 g/mol

IUPAC: 11-hydroxy-4-oxo-8-phenyl-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-2-carboxylic acid

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Overview

Molecular Formula C25H22O11
Molecular Weight 498.40 g/mol
Canonical SMILES C1=CC=C(C=C1)C2=C3C4=C(C=C2)C(=O)OC(C4=CC(=C3OC5C(C(C(C(O5)CO)O)O)O)O)C(=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy