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Substance Name: Benzoic acid, o-((2-amino-2-carboxy-1,1-dimethylethyl)dithio)-, D-
RN: 26885-63-2
InChIKey: LNMUCNBPPZDYED-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H15-N-O4-S2

Molecular Weight

  • 301.385
 
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Names and Synonyms

Synonym

  • D-o-((2-Amino-2-carboxy-1,1-dimethylethyl)dithio)benzoic acid

Systematic Name

  • Benzoic acid, o-((2-amino-2-carboxy-1,1-dimethylethyl)dithio)-, D-

Registry Numbers

CAS Registry Number

  • 26885-63-2

System Generated Number

  • 0026885632

Structure Descriptors

InChI

1S/C12H15NO4S2/c1-12(2,9(13)11(16)17)19-18-8-6-4-3-5-7(8)10(14)15/h3-6,9H,13H2,1-2H3,(H,14,15)(H,16,17)

InChIKey

LNMUCNBPPZDYED-UHFFFAOYSA-N

Smiles

C(c1c(cccc1)SSC([C@@H](C(=O)O)N)(C)C)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 868, 1971.