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Substance Name: Asalin
RN: 13425-94-0
InChIKey: LGLLXTFYYXSARU-GFOWMXPYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Reproductive Effect

Molecular Formula

  • C22-H33-Cl2-N3-O4

Molecular Weight

  • 474.426
 
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Names and Synonyms

Name of Substance

  • Asalin

Synonyms

  • Asalin
  • Asaline
  • Ethyl ester of N-acetyl-DL-sarcolysyl-DL-valine
  • N-Acetyl-sarcolysil valine ethyl ether

Systematic Names

  • L-Valine, N-(N-acetyl-4-(bis(2-chloroethyl)amino)phenylalanyl)-, ethyl ester (9CI)
  • N-Acetylsarcolysylvaline
  • Valine, N-(N-acetyl-3-(p-(bis(2-chloroethyl)amino)phenyl)alanyl)-, ethyl ester
  • Valine, N-(N-acetyl-4-(bis(2-chloroethyl)amino)phenylalanyl)-, ethyl ester (9CI)

Registry Numbers

CAS Registry Number

  • 13425-94-0

System Generated Number

  • 0013425940

Structure Descriptors

InChI

1S/C22H33Cl2N3O4/c1-5-31-22(30)20(15(2)3)26-21(29)19(25-16(4)28)14-17-6-8-18(9-7-17)27(12-10-23)13-11-24/h6-9,15,19-20H,5,10-14H2,1-4H3,(H,25,28)(H,26,29)/t19?,20-/m1/s1

InChIKey

LGLLXTFYYXSARU-GFOWMXPYSA-N

Smiles

C(=O)(OCC)[C@H](NC([C@@H](Cc1ccc(N(CCCl)CCCl)cc1)NC(=O)C)=O)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 187mg/kg (187mg/kg) BLOOD: LEUKOPENIA Pharmaceutical Chemistry Journal Vol. 12, Pg. 25, 1978.