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Substance Name: Glucoerucin
RN: 21973-56-8
InChIKey: GKUMMDFLKGFCKH-URYVQPGZSA-N

Molecular Formula

  • C12-H23-N-O9-S3

Molecular Weight

  • 421.51
 
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Names and Synonyms

Results Name

  • Glucoerucin

Name of Substance

  • Glucoerucin

Synonyms

  • CCRIS 9054
  • EINECS 244-689-8
  • Glucoerucin

Systematic Name

  • 1-Thio-beta-D-glucopyranose 1-(5-(methylthio)-N-(sulphooxy)valerimidate)

Registry Numbers

CAS Registry Number

  • 21973-56-8

System Generated Number

  • 0021973568

Structure Descriptors

InChI

1S/C12H23NO9S3/c1-23-5-3-2-4-8(13-22-25(18,19)20)24-12-11(17)10(16)9(15)7(6-14)21-12/h7,9-12,14-17H,2-6H2,1H3,(H,18,19,20)/t7-,9-,10+,11-,12+/m1/s1

InChIKey

GKUMMDFLKGFCKH-URYVQPGZSA-N

Smiles

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