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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP030296

[2-[2-(3,4-Dihydroxyphenyl)-5-hydroxy-6-methoxy-4-oxo-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-7-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl] acetate

Formula: C30H34O17  |  Mol. Weight: 666.60 g/mol

IUPAC: [2-[2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-4-oxo-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxychromen-7-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl] acetate

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Overview

Molecular Formula C30H34O17
Molecular Weight 666.60 g/mol
Canonical SMILES CC1C(C(C(C(O1)OC2=C(OC3=CC(=C(C(=C3C2=O)O)OC)OC4C(C(C(C(O4)C)O)OC(=O)C)O)C5=CC(=C(C=C5)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy