Glucopeonidin

CAS Registry Number®

6906-39-4
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CAS Name

Glucopeonidin

Molecular Formula

C22H23O11.Cl

Cite this Page

Glucopeonidin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=6906-39-4 (retrieved 2024-04-20) (CAS RN: 6906-39-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H22O11.ClH/c1-30-15-4-9(2-3-12(15)25)21-16(7-11-13(26)5-10(24)6-14(11)31-21)32-22-20(29)19(28)18(27)17(8-23)33-22;/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26);1H/t17-,18-,19+,20-,22-;/m1./s1

InChIKey

InChIKey=VDTNZDSOEFSAIZ-VXZFYHBOSA-N

SMILES

O(C=1C(=[O+]C2=C(C1)C(O)=CC(O)=C2)C3=CC(OC)=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(OC)C4

Other Names for this Substance

  • 1-Benzopyrylium, 3-(β-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-, chloride (1:1)
  • Flavylium, 3-(β-D-glucopyranosyloxy)-4′,5,7-trihydroxy-3′-methoxy-, chloride
  • 1-Benzopyrylium, 3-(β-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-, chloride
  • 3-(Glucosyloxy)-4′,5,7-trihydroxy-3′-methoxyflavylium chloride
  • Glucopyranoside, peonidin-3, β-D-

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Deleted or Replaced CAS Registry Numbers

29323-29-3, 30375-12-3, 30965-57-2, 53004-90-3, 906345-63-9

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