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Substance Name: Delphanin
RN: 28463-30-1
InChIKey: OUUYNFWYLXMNQZ-HNPHZNNWSA-N

Note

  • An anthocyanin isolated as purple colored crystals from eggplant peels.

Molecular Formula

  • C42-H47-O23.Cl

Molecular Weight

  • 955.2633
 
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Names and Synonyms

Results Name

  • Delphanin

Synonyms

  • Delphanin
  • Delphinidin-3-(4-p-coumaroylrhamnosyl(1-6)glucoside)-5-glucoside
  • Delphinidin-3-(p-coumaroylrutinoside)-5-glucoside
  • Nasunin
  • Violanin

Systematic Name

  • 1-Benzopyrylium, 3-((6-O-(6-deoxy-4-O-(3-(4-hydroxyphenyl)-1-oxo-2-propenyl)-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-5-(beta-D-glucopyranosyloxy)-7-hydroxy-2-(3,4,5-trihydroxyphenyl)-, chloride, (E)-

Registry Numbers

CAS Registry Number

  • 28463-30-1

Other Registry Numbers

  • 11021-46-8
  • 1401-80-5
  • 27253-63-0

System Generated Number

  • 0028463301

Molecular Formulas

Molecular Formula

  • C42-H47-O23.Cl

Molecular Formula Fragments

  • C42-H47-O23
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C42H46O23.ClH/c1-15-38(65-28(48)7-4-16-2-5-18(44)6-3-16)34(54)37(57)40(59-15)58-14-27-31(51)33(53)36(56)42(64-27)62-25-12-20-23(60-39(25)17-8-21(46)29(49)22(47)9-17)10-19(45)11-24(20)61-41-35(55)32(52)30(50)26(13-43)63-41;/h2-12,15,26-27,30-38,40-43,50-57H,13-14H2,1H3,(H4-,44,45,46,47,48,49);1H/t15-,26+,27+,30+,31+,32-,33-,34-,35+,36+,37+,38-,40-,41+,42+;/m0./s1

InChIKey

OUUYNFWYLXMNQZ-HNPHZNNWSA-N

Smiles

[Cl-].C[C@@H]1O[C@H](OC[C@H]2O[C@@H](Oc3cc4c(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)cc(O)cc4[o+]c3c6cc(O)c(O)c(O)c6)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1OC(=O)\C=C\c7ccc(O)cc7