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Substance Name: Alanine, N-benzyloxycarbonyl-3-phenyl-, 1,2-dibromoethyl ester, D-
RN: 64286-95-9
InChIKey: MKSYZNVUGBAASI-TZHYSIJRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H19-Br2-N-O4

Molecular Weight

  • 485.17
 
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Names and Synonyms

Synonym

  • D-N-Benzyloxycarbonyl-3-phenylalanine 1,2-dibromoethyl ester

Systematic Name

  • Alanine, N-benzyloxycarbonyl-3-phenyl-, 1,2-dibromoethyl ester, D-

Registry Numbers

CAS Registry Number

  • 64286-95-9

System Generated Number

  • 0064286959

Structure Descriptors

InChI

1S/C19H19Br2NO4/c20-12-17(21)26-18(23)16(11-14-7-3-1-4-8-14)22-19(24)25-13-15-9-5-2-6-10-15/h1-10,16-17H,11-13H2,(H,22,24)/t16-,17?/m1/s1

InChIKey

MKSYZNVUGBAASI-TZHYSIJRSA-N

Smiles

C([C@@H](Cc1ccccc1)NC(OCc1ccccc1)=O)(O[C@@H](CBr)Br)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1578, 1977.