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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP035775

Apigenin 7-O-(6''-malonyl-apiosyl-glucoside)

Formula: C29H30O17  |  Mol. Weight: 650.50 g/mol

IUPAC: 3-[[(2R,3S,4R,5R)-3,4-dihydroxy-5-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]oxolan-2-yl]methoxy]-3-oxopropanoic acid

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Overview

Molecular Formula C29H30O17
Molecular Weight 650.50 g/mol
Canonical SMILES C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)COC5C(C(C(O5)COC(=O)CC(=O)O)O)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy