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Substance Name: Xanthosine, 2'-deoxy-2'-(((2-methylnitrosoamino)carbonyl)amino)-
RN: 70865-72-4
InChIKey: XQIKZICQGZYZGH-QYYRPYCUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H15-N7-O7

Molecular Weight

  • 369.2925
 
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Names and Synonyms

Synonyms

  • 2'-Deoxy-2'-(((2-methylnitrosoamino)carbonyl)amino)xanthosine
  • 2'-Deoxy-2'-(3-methyl-3-nitrosoureido)xanthosine
  • BRN 1192229

Systematic Name

  • Xanthosine, 2'-deoxy-2'-(((2-methylnitrosoamino)carbonyl)amino)-

Registry Numbers

CAS Registry Number

  • 70865-72-4

System Generated Number

  • 0070865724

Structure Descriptors

InChI

1S/C12H15N7O7/c1-18(17-25)12(24)14-5-7(21)4(2-20)26-10(5)19-3-13-6-8(19)15-11(23)16-9(6)22/h3-5,7,10,20-21H,2H2,1H3,(H,14,24)(H2,15,16,22,23)/t4-,5-,7-,10-/m1/s1

InChIKey

XQIKZICQGZYZGH-QYYRPYCUSA-N

Smiles

CN(C(=O)N[C@@H]1[C@@H]([C@H](O[C@H]1n2cnc3c2[nH]c(=O)[nH]c3=O)CO)O)N=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 27, Pg. 765, 1979.