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Substance Name: Marein
RN: 535-96-6
InChIKey: XGEYXJDOVMEJNG-HTFDPZBKSA-N

Note

  • Hypoglycemic from Coreopsis tinctoria.

Molecular Formula

  • C21-H22-O11

Molecular Weight

  • 450.394
 
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Names and Synonyms

Results Name

  • Marein

Synonyms

  • EINECS 208-623-1
  • Marein
  • Okanin-4'-O-glucoside

Systematic Names

  • (E)-3-(3,4-Dihydroxyphenyl)-1-(4-(beta-D-glucopyranosyloxy)-2,3-dihydroxyphenyl)-2-propen-1-one
  • 2-Propen-1-one, 3-(3,4-dihydroxyphenyl)-1-(4-(beta-D-glucopyranosyloxy)-2,3-dihydroxyphenyl)-, (E)-

Registry Numbers

CAS Registry Number

  • 535-96-6

System Generated Number

  • 0000535966

Structure Descriptors

InChI

1S/C21H22O11/c22-8-15-18(28)19(29)20(30)21(32-15)31-14-6-3-10(16(26)17(14)27)11(23)4-1-9-2-5-12(24)13(25)7-9/h1-7,15,18-22,24-30H,8H2/b4-1+/t15-,18-,19+,20-,21-/m1/s1

InChIKey

XGEYXJDOVMEJNG-HTFDPZBKSA-N

Smiles

C(\C=C\c1cc(c(cc1)O)O)(=O)c1c(c(c(cc1)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)O)O