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Substance Name: L-Prolinamide, N-((hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-norvalyl-, (S)-, hemihydrate
RN: 128055-89-0
InChIKey: WRMYQWTXKLJNBF-DCAQKATOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H25-N5-O5.1/2H2-O

Molecular Weight

  • 367.4035
 
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Names and Synonyms

Synonym

  • RTECS UA0028000

Systematic Name

  • L-Prolinamide, N-((hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-norvalyl-, (S)-, hemihydrate

Registry Numbers

CAS Registry Number

  • 128055-89-0

System Generated Number

  • 0128055890

Molecular Formulas

Molecular Formula

  • C16-H25-N5-O5.1/2H2-O

Molecular Formula Fragments

  • C16-H25-N5-O5
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C16H25N5O5/c1-3-5-9(15(25)21-7-4-6-11(21)13(17)23)18-14(24)10-8-12(22)20(2)16(26)19-10/h9-11H,3-8H2,1-2H3,(H2,17,23)(H,18,24)(H,19,26)/t9-,10-,11-/m0/s1

InChIKey

WRMYQWTXKLJNBF-DCAQKATOSA-N

Smiles

CCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N)NC(=O)[C@@H]2CC(=O)N(C(=O)N2)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intravenous > 500mg/kg (500mg/kg)   Journal of Medicinal Chemistry. Vol. 33, Pg. 2130, 1990.