Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Valine, N-benzoyl-3-mercaptothio-
RN: 91641-20-2
InChIKey: OITWCAOQJMFLST-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H15-N-O2-S2

Molecular Weight

  • 285.3865
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • alpha-Benzolyamino-beta-mercaptoisovaleric-thiol acid
  • Butyric acid, 2-benzamido-3-mercapto-3-methylthio-
  • N-Benzoyl-3-mercaptothiovaline

Systematic Name

  • Valine, N-benzoyl-3-mercaptothio-

Registry Numbers

CAS Registry Number

  • 91641-20-2

System Generated Number

  • 0091641202

Structure Descriptors

InChI

1S/C12H15NO3S2/c1-12(2,18-17)9(11(15)16)13-10(14)8-6-4-3-5-7-8/h3-7,9,17H,1-2H3,(H,13,14)(H,15,16)

InChIKey

OITWCAOQJMFLST-UHFFFAOYSA-N

Smiles

CC(C)(C(C(=O)O)NC(=O)c1ccccc1)SS

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 600mg/kg (600mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 136, Pg. 452, 1962.