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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038997

1-[4-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-hydroxyphenyl]-2-(4-methoxyphenyl)ethane-1,2-dione

Formula: C26H30O14  |  Mol. Weight: 566.50 g/mol

IUPAC: 1-[4-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-hydroxyphenyl]-2-(4-methoxyphenyl)ethane-1,2-dione

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Overview

Molecular Formula C26H30O14
Molecular Weight 566.50 g/mol
Canonical SMILES COC1=CC=C(C=C1)C(=O)C(=O)C2=C(C=C(C=C2)OC3C(C(C(C(O3)COC4C(C(CO4)(CO)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy