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Substance Name: Thionigerose
RN: 159495-64-4
InChIKey: XRTVCRDMGYFFNB-NMCXEIBESA-N

Molecular Formula

  • C12-H22-O10-S

Molecular Weight

  • 358.362
 
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Names and Synonyms

Name of Substance

  • Thionigerose

Synonyms

  • 3-S-(alpha-D-Glucopyranosyl)-3-thio-D-glucose
  • 3-S-alpha-D-glucopyranosyl-3-thio-alpha-D-Glucopyranose
  • 3-S-Glucopyranosyl-3-thioglucose

Systematic Name

  • alpha-D-Glucopyranose, 3-S-alpha-D-glucopyranosyl-3-thio-

Registry Numbers

CAS Registry Number

  • 159495-64-4

System Generated Number

  • 0159495644

Structure Descriptors

InChI

1S/C12H22O10S/c13-1-3-5(15)7(17)8(18)12(22-3)23-10-6(16)4(2-14)21-11(20)9(10)19/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8-,9-,10+,11+,12-/m1/s1

InChIKey

XRTVCRDMGYFFNB-NMCXEIBESA-N

Smiles

S([C@@H]1[C@@H]([C@H]([C@H](O)[C@H](O1)CO)O)O)[C@@H]1[C@H]([C@H](O[C@@H]([C@H]1O)CO)O)O