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Substance Name: Alanine, N-benzyloxycarbonyl-3,3-dimethyl-, 2-propynyl ester, L-
RN: 73680-52-1
InChIKey: AHVKUWXEUVEHIV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H19-N-O4

Molecular Weight

  • 289.329
 
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Names and Synonyms

Synonym

  • L-N-Benzyloxycarbonyl-3,3-dimethylalanine 2-propynyl ester

Systematic Name

  • Alanine, N-benzyloxycarbonyl-3,3-dimethyl-, 2-propynyl ester, L-

Registry Numbers

CAS Registry Number

  • 73680-52-1

System Generated Number

  • 0073680521

Structure Descriptors

InChI

1S/C16H19NO4/c1-4-10-20-15(18)14(12(2)3)17-16(19)21-11-13-8-6-5-7-9-13/h1,5-9,12,14H,10-11H2,2-3H3,(H,17,19)

InChIKey

AHVKUWXEUVEHIV-UHFFFAOYSA-N

Smiles

N([C@@H](C(OCC#C)=O)C(C)C)C(OCc1ccccc1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 477mg/kg (477mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1584, 1977.