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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP017434

[2-(3,5-Dihydroxy-4-phenoxycarbonyloxy-phenyl)-5-hydroxy-chroman-7-yl] 3,4,5-trihydroxybenzoate

Formula: C29H22O12  |  Mol. Weight: 562.50 g/mol

IUPAC: [2-(3,5-dihydroxy-4-phenoxycarbonyloxyphenyl)-5-hydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate

Overview

Molecular Formula C29H22O12
Molecular Weight 562.50 g/mol
Canonical SMILES C1CC2=C(C=C(C=C2OC1C3=CC(=C(C(=C3)O)OC(=O)OC4=CC=CC=C4)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy