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Substance Name: GYKI 14166
RN: 83997-16-4
InChIKey: RMYMBMLRPYLYDX-VNMUXGFYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H30-N6-O3.H2-O4-S

Molecular Weight

  • 500.5738
 
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Names and Synonyms

Results Name

  • GYKI 14166

Synonyms

  • (S)-D-Phenylalanyl-N-(4-((aminoiminomethyl)amino)-1-formylbutyl)-L-prolinamide sulfate (1:1)
  • D-Phenylalanyl-L-prolyl-L-arginine aldehyde sulfate (1:1)
  • GYKI 14166
  • RGH-2958

Systematic Name

  • L-Prolinamide, N-(4-((aminoiminomethyl)amino)-1-formylbutyl)-D-phenylalanyl-, sulfate, (S)-

Registry Numbers

CAS Registry Number

  • 83997-16-4

System Generated Number

  • 0083997164

Molecular Formulas

Molecular Formula

  • C20-H30-N6-O3.H2-O4-S

Molecular Formula Fragments

  • C20-H30-N6-O3
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/C20H30N6O3.H2O4S/c21-16(12-14-6-2-1-3-7-14)18(28)25-19(29)17-9-5-11-26(17)15(13-27)8-4-10-24-20(22)23;1-5(2,3)4/h1-3,6-7,13,15-17H,4-5,8-12,21H2,(H4,22,23,24)(H,25,28,29);(H2,1,2,3,4)/t15-,16+,17-;/m0./s1

InChIKey

RMYMBMLRPYLYDX-VNMUXGFYSA-N

Smiles

c1ccc(cc1)C[C@H](C(=O)NC(=O)[C@@H]2CCCN2[C@@H](CCCNC(=N)N)C=O)N.OS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 225mg/kg (225mg/kg)   Drugs of the Future. Vol. 10, Pg. 829, 1985.
mouse LD50 intravenous 45mg/kg (45mg/kg)   Drugs of the Future. Vol. 10, Pg. 829, 1985.
mouse LD50 oral 1250mg/kg (1250mg/kg)   Drugs of the Future. Vol. 10, Pg. 829, 1985.
rabbit LD50 intravenous 40mg/kg (40mg/kg)   Journal of Medicinal Chemistry. Vol. 33, Pg. 1729, 1990.
rabbit LD50 oral > 1500mg/kg (1500mg/kg)   Journal of Medicinal Chemistry. Vol. 33, Pg. 1729, 1990.