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Substance Name: N-((2-Chloroethyl)nitrosocarbamoyl)-L-threonine
RN: 80687-08-7
InChIKey: UFEWHGLVHGVTFY-UHNVWZDZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H12-Cl-N3-O5

Molecular Weight

  • 253.6408
 
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Names and Synonyms

Name of Substance

  • N-((2-Chloroethyl)nitrosocarbamoyl)-L-threonine

Synonyms

  • BRN 5562889
  • L-Threonine, N-(((2-chloroethyl)nitrosoamino)carbonyl)-
  • N-((2-Chloroethyl)nitrosocarbamoyl)-L-threonine
  • N-(Chloro-2 ethyl)-N-nitrosocarbamyl-L-threonine
  • N-(Chloro-2 ethyl)-N-nitrosocarbamyl-L-threonine [French]
  • NSC 356558

Systematic Name

  • Threonine, N-((2-chloroethyl)nitrosocarbamoyl)-, L-

Registry Numbers

CAS Registry Number

  • 80687-08-7

System Generated Number

  • 0080687087

Structure Descriptors

InChI

1S/C7H12ClN3O5/c1-4(12)5(6(13)14)9-7(15)11(10-16)3-2-8/h4-5,12H,2-3H2,1H3,(H,9,15)(H,13,14)/t4-,5+/m1/s1

InChIKey

UFEWHGLVHGVTFY-UHNVWZDZSA-N

Smiles

C[C@@H](O)[C@H](NC(=O)N(CCCl)N=O)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 110mg/kg (110mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 19, Pg. 512, 1984.