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Substance Name: Epiprogoitrin
RN: 19237-18-4
InChIKey: MYHSVHWQEVDFQT-QSKOKFRPSA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C11-H19-N-O10-S2

Molecular Weight

  • 389.4
 
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Names and Synonyms

Results Name

  • Epiprogoitrin

Synonyms

  • 1-Thio-beta-D-glucopyranose 1-((3S)-3-hydroxy-N-(sulfooxy)-4-pentenimidate)
  • 2(S)-Hydroxy-3-butenylglucosinolate
  • AI3-52767
  • epi-Progoitrin
  • Epiprogoitrin

Systematic Names

  • beta-D-Glucopyranose, 1-thio-, 1-((3S)-3-hydroxy-N-(sulfooxy)-4-pentenimidate)
  • beta-D-Glucopyranose, 1-thio-, 1-(3-hydroxy-N-(sulfooxy)-4-pentenimidate), (S)- (9CI)
  • Glucopyranose, 1-thio-, 1-((S)-3-hydroxy-4-pentenohydroximate) NO-(hydrogen sulfate), beta-D-

Registry Numbers

CAS Registry Number

  • 19237-18-4

System Generated Number

  • 0019237184

Structure Descriptors

InChI

1S/C11H19NO10S2/c1-2-5(14)3-7(12-22-24(18,19)20)23-11-10(17)9(16)8(15)6(4-13)21-11/h2,5-6,8-11,13-17H,1,3-4H2,(H,18,19,20)/b12-7+/t5-,6-,8-,9+,10-,11+/m1/s1

InChIKey

MYHSVHWQEVDFQT-QSKOKFRPSA-N

Smiles

O1[C@@H](S\C(C[C@H](O)C=C)=N\OS(O)(=O)=O)[C@@H]([C@H]([C@@H](O)[C@H]1CO)O)O