Cyanidin 3,5-diglucoside

CAS Registry Number®

2611-67-8
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CAS Name

Cyanidin 3,5-diglucoside

Molecular Formula

C27H31O16.Cl

Cite this Page

Cyanidin 3,5-diglucoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2611-67-8 (retrieved 2024-04-30) (CAS RN: 2611-67-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    203-204 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C27H30O16.ClH/c28-7-17-19(33)21(35)23(37)26(42-17)40-15-5-10(30)4-14-11(15)6-16(25(39-14)9-1-2-12(31)13(32)3-9)41-27-24(38)22(36)20(34)18(8-29)43-27;/h1-6,17-24,26-29,33-38H,7-8H2,(H2-,30,31,32);1H/t17-,18-,19-,20-,21+,22+,23-,24-,26-,27-;/m1./s1

InChIKey

InChIKey=QDVZZZBBPRFPDG-DHJOXOLYSA-N

SMILES

O(C=1C2=C([O+]=C(C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C2)C4=CC(O)=C(O)C=C4)C=C(O)C1)[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O.[Cl-]

Canonical SMILES

[Cl-].OC=1C=C(OC2OC(CO)C(O)C(O)C2O)C=3C=C(OC4OC(CO)C(O)C(O)C4O)C(=[O+]C3C1)C=5C=CC(O)=C(O)C5

Other Names for this Substance

  • 1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3,5-bis(β-D-glucopyranosyloxy)-7-hydroxy-, chloride (1:1)
  • Cyanin
  • 1-Benzopyrylium, 2-(3,4-dihydroxyphenyl)-3,5-bis(β-D-glucopyranosyloxy)-7-hydroxy-, chloride
  • Cyanin chloride
  • Cyanidol 3,5-diglucoside chloride

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Deleted or Replaced CAS Registry Numbers

1405-73-8, 28986-96-1, 30972-20-4, 75017-04-8

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