Cyanidin 3-glucoside

CAS Registry Number®

7084-24-4
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CAS Name

Cyanidin 3-glucoside

Molecular Formula

C21H21O11.Cl

Cite this Page

Cyanidin 3-glucoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=7084-24-4 (retrieved 2021-10-22) (CAS RN: 7084-24-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H20O11.ClH/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8;/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26);1H/t16-,17-,18+,19-,21-;/m1./s1

InChIKey

InChIKey=YTMNONATNXDQJF-UBNZBFALSA-N

SMILES

O(C=1C(=[O+]C2=C(C1)C(O)=CC(O)=C2)C3=CC(O)=C(O)C=C3)[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O.[Cl-]

Canonical SMILES

[Cl-].OC=1C=C(O)C=2C=C(OC3OC(CO)C(O)C(O)C3O)C(=[O+]C2C1)C=4C=CC(O)=C(O)C4

Other Names for this Substance

  • 1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-(β-D-glucopyranosyloxy)-5,7-dihydroxy-, chloride (1:1)
  • Chrysanthemin
  • 1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3-(β-D-glucopyranosyloxy)-5,7-dihydroxy-, chloride
  • Cyanidin 3-monoglucoside
  • Cyanidin 3-β-D-glucopyranoside

Deleted or Replaced CAS Registry Numbers

1329-20-0, 11019-11-7, 19471-39-7, 27554-23-0, 30677-11-3, 93913-29-2, 143637-10-9