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Substance Name: Deglucohyrcanoside
RN: 14614-16-5
InChIKey: ZQVQSPBMCILIHV-WSDZJMHASA-N

Note

  • From seeds of Coronilla varia L.

Molecular Formula

  • C28-H38-O9

Molecular Weight

  • 518.5992
 
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Names and Synonyms

Name of Substance

  • Deglucohyrcanoside

Synonyms

  • (3beta)-14-Hydroxy-19-oxo-3-(beta-D-xylopyranosyloxy)card-20(22)-enolide
  • Deglucohyrcanoside
  • NSC 281266

Systematic Name

  • Card-20(22)-enolide, 14-hydroxy-19-oxo-3-(beta-D-xylopyranosyloxy)-, (3beta)-

Registry Numbers

CAS Registry Number

  • 14614-16-5

System Generated Number

  • 0014614165

Structure Descriptors

InChI

1S/C28H38O9/c1-26-7-5-19-20(28(26,34)9-6-18(26)15-10-22(31)35-12-15)3-2-16-11-17(4-8-27(16,19)14-29)37-25-24(33)23(32)21(30)13-36-25/h10-11,14,17-21,23-25,30,32-34H,2-9,12-13H2,1H3/t17-,18+,19-,20+,21-,23-,24+,25-,26+,27+,28-/m0/s1

InChIKey

ZQVQSPBMCILIHV-WSDZJMHASA-N

Smiles

C[C@]12CC[C@H]3[C@H]([C@]1(CC[C@@H]2C4=CC(=O)OC4)O)CCC5=C[C@H](CC[C@]35C=O)O[C@H]6[C@@H]([C@H]([C@H](CO6)O)O)O