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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP030672

[2-[3-(4-Acetyloxy-3,5-dihydroxy-6-methyloxan-2-yl)oxy-5-hydroxy-2-(4-hydroxyphenyl)-6-methoxy-4-oxochromen-7-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl] acetate

Formula: C32H36O17  |  Mol. Weight: 692.60 g/mol

IUPAC: [2-[3-(4-acetyloxy-3,5-dihydroxy-6-methyloxan-2-yl)oxy-5-hydroxy-2-(4-hydroxyphenyl)-6-methoxy-4-oxochromen-7-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl] acetate

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Overview

Molecular Formula C32H36O17
Molecular Weight 692.60 g/mol
Canonical SMILES CC1C(C(C(C(O1)OC2=C(C(=C3C(=C2)OC(=C(C3=O)OC4C(C(C(C(O4)C)O)OC(=O)C)O)C5=CC=C(C=C5)O)O)OC)O)OC(=O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy