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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP022547

Apiopaeonoside

Formula: C20H28O12  |  Mol. Weight: 460.40 g/mol

IUPAC: 1-[2-[6-[[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-4-methoxyphenyl]ethanone

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Overview

Molecular Formula C20H28O12
Molecular Weight 460.40 g/mol
Canonical SMILES CC(=O)C1=C(C=C(C=C1)OC)OC2C(C(C(C(O2)COC3C(C(CO3)(CO)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy