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Substance Name: Cyanidin 3-o-sambubioside ion
RN: 63535-17-1
UNII: 7RKF71MYMB
InChIKey: ZPPQIOUITZSYAO-AOBOYTTNSA-O

Molecular Formula

  • C26-H29-O15

Molecular Weight

  • 581.5001
 
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Names and Synonyms

Name of Substance

  • Cyanidin 3-o-sambubioside ion

Synonyms

  • Cyanidin 3-o-sambubioside ion
  • UNII-7RKF71MYMB

Registry Numbers

CAS Registry Number

  • 63535-17-1

FDA UNII

  • 7RKF71MYMB

System Generated Number

  • 0063535171

Structure Descriptors

InChI

1S/C26H28O15/c27-7-18-20(34)21(35)24(41-25-22(36)19(33)15(32)8-37-25)26(40-18)39-17-6-11-13(30)4-10(28)5-16(11)38-23(17)9-1-2-12(29)14(31)3-9/h1-6,15,18-22,24-27,32-36H,7-8H2,(H3-,28,29,30,31)/p+1/t15-,18-,19+,20-,21+,22-,24-,25+,26-/m1/s1

InChIKey

ZPPQIOUITZSYAO-AOBOYTTNSA-O

Smiles

OC[C@H]1O[C@@H](Oc2cc3c(O)cc(O)cc3[o+]c2c4ccc(O)c(O)c4)[C@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@@H]1O