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Substance Name: Vomilenine beta-D-glucoside
RN: 31282-07-2
InChIKey: OSJPGOJPRNTSHP-GQWMXSCHSA-N

Molecular Formula

  • C27-H32-N2-O8

Molecular Weight

  • 512.5558
 
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Names and Synonyms

Results Name

  • Vomilenine beta-D-glucoside

Synonyms

  • EINECS 250-546-0
  • Raucaffricin
  • Raucaffricine
  • Vomilenine beta-D-glucopyranoside
  • Vomilenine beta-D-glucoside

Systematic Name

  • (17R,19E,21alpha)-17-Acetoxy-1,2,19,20-tetradehydro-1-demethylajmalan-21-yl beta-D-glucopyranoside

Registry Numbers

CAS Registry Number

  • 31282-07-2

Other Registry Number

  • 11046-67-6

System Generated Number

  • 0031282072

Structure Descriptors

InChI

1S/C27H32N2O8/c1-3-12-13-8-16-23-27(14-6-4-5-7-15(14)28-23)9-17(19(13)24(27)35-11(2)31)29(16)25(12)37-26-22(34)21(33)20(32)18(10-30)36-26/h3-7,13,16-22,24-26,30,32-34H,8-10H2,1-2H3/b12-3+/t13?,16-,17-,18+,19?,20+,21-,22+,24+,25+,26-,27?/m0/s1

InChIKey

OSJPGOJPRNTSHP-GQWMXSCHSA-N

Smiles

C/C=C\1/[C@H](N2[C@H]3CC1C4[C@@H]2CC5([C@@H]4OC(=O)C)C3=Nc6c5cccc6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O