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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP010677

2,2-bis(4-hydroxy-3-methoxyphenyl)-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,3-dioxin-4-one

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

IUPAC: 2,2-bis(4-hydroxy-3-methoxyphenyl)-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,3-dioxin-4-one

Overview

Molecular Formula C25H28O13
Molecular Weight 536.50 g/mol
Canonical SMILES COC1=C(C=CC(=C1)C2(OC=C(C(=O)O2)COC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C=C4)O)OC)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy