Gentioside (xanthone)

CAS Registry Number®

529-48-6

CAS Name

Gentioside (xanthone)

Molecular Formula

C25H28O14

Molecular Mass

552.48

Cite this Page

Gentioside (xanthone).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=529-48-6 (retrieved 2024-12-24) (CAS RN: 529-48-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H28O14/c1-34-9-2-3-14-11(4-9)18(28)17-12(26)5-10(6-15(17)38-14)37-25-23(33)21(31)20(30)16(39-25)8-36-24-22(32)19(29)13(27)7-35-24/h2-6,13,16,19-27,29-33H,7-8H2,1H3/t13-,16-,19+,20-,21+,22-,23-,24+,25-/m1/s1

InChIKey

InChIKey=DNIDCQUDANKQTL-ILFMMJCVSA-N

SMILES

O=C1C=2C(OC=3C1=CC(OC)=CC3)=CC(O[C@@H]4O[C@H](CO[C@H]5[C@H](O)[C@@H](O)[C@H](O)CO5)[C@@H](O)[C@H](O)[C@H]4O)=CC2O

Canonical SMILES

O=C1C2=CC(OC)=CC=C2OC3=CC(OC4OC(COC5OCC(O)C(O)C5O)C(O)C(O)C4O)=CC(O)=C13

Other Names for this Substance

  • 9H-Xanthen-9-one, 1-hydroxy-7-methoxy-3-[(6-O-β-D-xylopyranosyl-β-D-glucopyranosyl)oxy]-
  • 1-Hydroxy-7-methoxy-3-[(6-O-β-D-xylopyranosyl-β-D-glucopyranosyl)oxy]-9H-xanthen-9-one
  • Gentioside
  • Gentioside (xanthone)

CAS INSIGHTSTM
Pile of blue, green, and white color of capsule pills with modern design light.