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Substance Name: Cyanidin 3-rutinoside
RN: 28338-59-2
UNII: OR49FC491X
InChIKey: USNPULRDBDVJAO-FXCAAIILSA-O

Molecular Formula

  • C27-H31-O15

Molecular Weight

  • 595.5269
 
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Names and Synonyms

Results Name

  • Cyanidin 3-rutinoside

Name of Substance

  • Keracyanin ion

Synonyms

  • Cyanidin 3-beta-D-O-rutinoside
  • Cyanidin 3-O-rutinoside
  • Cyanidin 3-rutinoside
  • UNII-OR49FC491X

Systematic Name

  • 1-Benzopyrylium, 3-((6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-

Registry Numbers

CAS Registry Number

  • 28338-59-2

FDA UNII

  • OR49FC491X

Other Registry Number

  • 259813-55-3

System Generated Number

  • 0028338592

Structure Descriptors

InChI

1S/C27H30O15/c1-9-19(32)21(34)23(36)26(39-9)38-8-18-20(33)22(35)24(37)27(42-18)41-17-7-12-14(30)5-11(28)6-16(12)40-25(17)10-2-3-13(29)15(31)4-10/h2-7,9,18-24,26-27,32-37H,8H2,1H3,(H3-,28,29,30,31)/p+1/t9-,18+,19-,20+,21+,22-,23+,24+,26+,27+/m0/s1

InChIKey

USNPULRDBDVJAO-FXCAAIILSA-O

Smiles

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)Oc3cc4c(cc(cc4[o+]c3c5ccc(c(c5)O)O)O)O)O)O)O)O)O)O