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Substance Name: Glycinamide, L-alanyl-N-(2-mercaptoethyl)-, (2-2')-disulfide, bis(trifluoroacetate)
RN: 117370-29-3
InChIKey: DHYAMVWMAJFAJM-BZDVOYDHSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H28-N6-O4-S2.2C2-H-F3-O2

Molecular Weight

  • 636.589
 
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Names and Synonyms

Synonym

  • L-Alanyl-N-(2-mercaptoethyl)glycinamide (2-2')-disulfide bis(trifluoroacetate)

Systematic Name

  • Glycinamide, L-alanyl-N-(2-mercaptoethyl)-, (2-2')-disulfide, bis(trifluoroacetate)

Registry Numbers

CAS Registry Number

  • 117370-29-3

System Generated Number

  • 0117370293

Molecular Formulas

Molecular Formula

  • C14-H28-N6-O4-S2.2C2-H-F3-O2

Molecular Formula Fragments

  • C14-H28-N6-O4-S2
  • C2-H-F3-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C14H28N6O4S2.2C2HF3O2/c1-9(15)13(23)19-7-11(21)17-3-5-25-26-6-4-18-12(22)8-20-14(24)10(2)16;2*3-2(4,5)1(6)7/h9-10H,3-8,15-16H2,1-2H3,(H,17,21)(H,18,22)(H,19,23)(H,20,24);2*(H,6,7)/t9-,10-;;/m0../s1

InChIKey

DHYAMVWMAJFAJM-BZDVOYDHSA-N

Smiles

C[C@@H](C(=O)NCC(=O)NCCSSCCNC(=O)CNC(=O)[C@H](C)N)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1500mg/kg (1500mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 297, 1989.