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Substance Name: Metamelfalan, (+/-)-
RN: 1088-79-5
UNII: 8BA40E8GDC
InChIKey: QDGAVODICPCDMU-UHFFFAOYSA-N

Molecular Formula

  • C13-H18-Cl2-N2-O2

Molecular Weight

  • 305.203
 
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Names and Synonyms

Name of Substance

  • Metamelfalan, (+/-)-

Synonyms

  • 3-(Bis(2-chloroethyl)amino)-DL-phenylalanine
  • 3-(m-(Bis(2-chloroethyl)amino)phenyl)-DL-alanine
  • DL-Alanine, 3-(m-(bis(2-chloroethyl)amino)phenyl)-
  • m-DL-Sarcolysin
  • m-DL-Sarcolysine
  • MP 267
  • NSC 27381
  • UNII-8BA40E8GDC

Systematic Names

  • Alanine, 3-(m-(bis(2-chloroethyl)amino)phenyl)-, DL-
  • DL-Phenylalanine, 3-(bis(2-chloroethyl)amino)- (9CI)

Registry Numbers

CAS Registry Number

  • 1088-79-5

FDA UNII

  • 8BA40E8GDC

System Generated Number

  • 0001088795

Structure Descriptors

InChI

1S/C13H18Cl2N2O2/c14-4-6-17(7-5-15)11-3-1-2-10(8-11)9-12(16)13(18)19/h1-3,8,12H,4-7,9,16H2,(H,18,19)

InChIKey

QDGAVODICPCDMU-UHFFFAOYSA-N

Smiles

c1(N(CCCl)CCCl)cc(ccc1)C[C@@H](C(O)=O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 10790ug/kg (10.79mg/kg)   National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. Vol. JAN1986,
rat LD50 intracrebral 625ug/kg (0.625mg/kg)   Journal of Pharmacy and Pharmacology. Vol. 18, Pg. 760, 1966.