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Substance Name: 6-Mercaptopurine deoxyriboside
RN: 2239-64-7
InChIKey: WACLJMMBCDNRJE-RRKCRQDMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H12-N4-O3-S

Molecular Weight

  • 268.2958
 
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Names and Synonyms

Results Name

  • 6-Mercaptopurine deoxyriboside

Synonyms

  • 2'-Deoxy-6-thioinosine
  • 6-Mercaptopurine deoxyriboside
  • 6-Mercaptopurine-2'-deoxyribonucleoside
  • 9-(2-Deoxy-beta-D-erythro-pentofuranosyl)-9H-purine-6(1H)-thiol
  • NSC 409366
  • NSC 90557

Systematic Names

  • 9H-Purine-6(1H)-thione, 9-(2-deoxy-beta-D-erythro-pentofuranosyl)-
  • Inosine, 2'-deoxy-6-thio- (9CI)

Registry Numbers

CAS Registry Number

  • 2239-64-7

System Generated Number

  • 0002239647

Structure Descriptors

InChI

1S/C10H12N4O3S/c15-2-6-5(16)1-7(17-6)14-4-13-8-9(14)11-3-12-10(8)18/h3-7,15-16H,1-2H2,(H,11,12,18)/t5-,6+,7+/m0/s1

InChIKey

WACLJMMBCDNRJE-RRKCRQDMSA-N

Smiles

c1[nH]c(=S)c2c(n1)n(cn2)[C@H]3C[C@@H]([C@H](O3)CO)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2100mg/kg (2100mg/kg)   Takeda Kenkyusho Nempo. Annual Report of the Takeda Research Laboratories. Vol. 27, Pg. 1, 1968.
mouse LD50 oral 1700mg/kg (1700mg/kg)   Takeda Kenkyusho Nempo. Annual Report of the Takeda Research Laboratories. Vol. 27, Pg. 1, 1968.