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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP002862

Gentioside (xanthone)

Formula: C25H28O14  |  Mol. Weight: 552.50 g/mol

IUPAC: 1-hydroxy-7-methoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyxanthen-9-one

Overview

Molecular Formula C25H28O14
Molecular Weight 552.50 g/mol
Canonical SMILES COC1=CC2=C(C=C1)OC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)COC5C(C(C(CO5)O)O)O)O)O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy