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Substance Name: Petunidin 3-arabinoside cation
RN: 749848-37-1
UNII: 883V52542W
InChIKey: XYWFSSFJPFAYCA-KZCJGOGDSA-O

Molecular Formula

  • C21-H21-O11

Molecular Weight

  • 449.3859
 
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Names and Synonyms

Name of Substance

  • Petunidin 3-arabinoside cation

Synonyms

  • 1-Benzopyrylium, 3-(alpha-L-arabinopyranosyloxy)-2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-
  • 1-Benzopyrylium, 3-(arabinosyloxy)-2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-
  • Petunidin 3-arabinoside cation
  • Petunidin-3-o-arabinoside cation
  • UNII-883V52542W

Registry Numbers

CAS Registry Number

  • 749848-37-1

FDA UNII

  • 883V52542W

System Generated Number

  • 0749848371

Structure Descriptors

InChI

1S/C21H20O11/c1-29-15-3-8(2-12(24)17(15)26)20-16(32-21-19(28)18(27)13(25)7-30-21)6-10-11(23)4-9(22)5-14(10)31-20/h2-6,13,18-19,21,25,27-28H,7H2,1H3,(H3-,22,23,24,26)/p+1/t13-,18-,19+,21-/m0/s1

InChIKey

XYWFSSFJPFAYCA-KZCJGOGDSA-O

Smiles

COc1cc(cc(c1O)O)c2c(cc3c(cc(cc3[o+]2)O)O)O[C@H]4[C@@H]([C@H]([C@H](CO4)O)O)O