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Substance Name: Thiarabine monohydrate
RN: 1060763-85-0
UNII: 330BCY70IG
InChIKey: WZNQMDRAAPUYQI-JBMRGDGGSA-N

Molecular Formula

  • C9-H13-N3-O4-S.H2-O

Molecular Weight

  • 277.2995
 
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Names and Synonyms

Name of Substance

  • Thiarabine monohydrate

Synonyms

  • 2(1H)-Pyrimidinone, 4-amino-1-(4-thio-beta-D-arabinofuranosyl)-, hydrate (1:1)
  • 4'-Thio-arac monohydrate
  • OSI-7836 monohydrate
  • Thiarabine monohydrate
  • UNII-330BCY70IG

Registry Numbers

CAS Registry Number

  • 1060763-85-0

FDA UNII

  • 330BCY70IG

System Generated Number

  • 1060763850

Structure Descriptors

InChI

1S/C9H13N3O4S.H2O/c10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13)17-8;/h1-2,4,6-8,13-15H,3H2,(H2,10,11,16);1H2/t4-,6-,7+,8-;/m1./s1

InChIKey

WZNQMDRAAPUYQI-JBMRGDGGSA-N

Smiles

c1cn(c(=O)nc1N)[C@H]2[C@H]([C@@H]([C@H](S2)CO)O)O.O