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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP016046

(2S,3R,4S,5S,6R)-2-[4-[(3R,3aS,6R,6aS)-3a,6a-dihydroxy-3-(4-hydroxy-3-methoxyphenyl)-1,3,4,6-tetrahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

Formula: C26H32O13  |  Mol. Weight: 552.50 g/mol

IUPAC: (2S,3R,4S,5S,6R)-2-[4-[(3R,3aS,6R,6aS)-3a,6a-dihydroxy-3-(4-hydroxy-3-methoxyphenyl)-1,3,4,6-tetrahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

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Overview

Molecular Formula C26H32O13
Molecular Weight 552.50 g/mol
Canonical SMILES COC1=C(C=CC(=C1)C2C3(COC(C3(CO2)O)C4=CC(=C(C=C4)OC5C(C(C(C(O5)CO)O)O)O)OC)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy