Chrysophanol 8-O-β-D-glucopyranoside

CAS Registry Number®

13241-28-6
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CAS Name

Chrysophanol 8-O-β-D-glucopyranoside

Molecular Formula

C21H20O9

Molecular Mass

416.38

Cite this Page

Chrysophanol 8-O-β-D-glucopyranoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=13241-28-6 (retrieved 2024-04-28) (CAS RN: 13241-28-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    110 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H20O9/c1-8-5-10-14(11(23)6-8)18(26)15-9(16(10)24)3-2-4-12(15)29-21-20(28)19(27)17(25)13(7-22)30-21/h2-6,13,17,19-23,25,27-28H,7H2,1H3/t13-,17-,19+,20-,21-/m1/s1

InChIKey

InChIKey=WMMOMSNMMDMSRB-JNHRPPPUSA-N

SMILES

O(C1=C2C(C(=O)C=3C(C2=O)=C(O)C=C(C)C3)=CC=C1)[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O

Canonical SMILES

O=C1C=2C=CC=C(OC3OC(CO)C(O)C(O)C3O)C2C(=O)C4=C(O)C=C(C=C14)C

Other Names for this Substance

  • 9,10-Anthracenedione, 8-(β-D-glucopyranosyloxy)-1-hydroxy-3-methyl-
  • Glucopyranoside, 8-hydroxy-6-methyl-1-anthraquinonyl, β-D-
  • Glucopyranoside, 8-hydroxy-6-methyl-1-anthraquinonyl
  • Anthraquinone, 8-(β-D-glucopyranosyloxy)-1-hydroxy-3-methyl-
  • 8-(β-D-Glucopyranosyloxy)-1-hydroxy-3-methyl-9,10-anthracenedione

Deleted or Replaced CAS Registry Numbers

100456-00-6, 1213240-01-7

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