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Substance Name: Peonidin
RN: 134-01-0
UNII: D0O766G47B
InChIKey: OGBSHLKSHNAPEW-UHFFFAOYSA-N

Note

  • A COX-2 inhibitor with protein kinase inhibitory and phytogenic antineoplastic activities.

Molecular Formula

  • C16-H13-O6.Cl

Molecular Weight

  • 336.7257
 
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Names and Synonyms

Name of Substance

  • Peonidin

Synonyms

  • EINECS 205-125-6
  • Peonidin
  • UNII-D0O766G47B

Systematic Names

  • 1-Benzopyrylium, 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-, chloride
  • 3,5,7-Trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-1-benzopyrylium chloride

Registry Numbers

CAS Registry Number

  • 134-01-0

FDA UNII

  • D0O766G47B

System Generated Number

  • 0000134010

Molecular Formulas

Molecular Formula

  • C16-H13-O6.Cl

Molecular Formula Fragments

  • C16-H13-O6
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C16H12O6.ClH/c1-21-15-4-8(2-3-11(15)18)16-13(20)7-10-12(19)5-9(17)6-14(10)22-16;/h2-7H,1H3,(H3-,17,18,19,20);1H

InChIKey

OGBSHLKSHNAPEW-UHFFFAOYSA-N

Smiles

[o+]1c(c(cc2c1cc(cc2O)O)O)c1cc(c(cc1)O)OC.[ClH-]