Melagatran

For research use only. Not for therapeutic Use.

  • CAT Number: R008238
  • CAS Number: 159776-70-2
  • Molecular Formula: C22H31N5O4
  • Molecular Weight: 429.521
  • Purity: ≥95%
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Catalog Number R008238
CAS Number 159776-70-2
Synonyms

N-[(1R)-2-[(2S)-2-[[[[4-(Aminoiminomethyl)phenyl]methyl]amino]carbonyl]-1-azetidinyl]-1-cyclohexyl-2-oxoethyl]glycine; H-319/68;

Molecular Formula C22H31N5O4
Purity ≥95%
Target Thrombin
Storage Store at -20°C
IUPAC Name 2-[[(1R)-2-[(2S)-2-[(4-carbamimidoylphenyl)methylcarbamoyl]azetidin-1-yl]-1-cyclohexyl-2-oxoethyl]amino]acetic acid
InChI InChI=1S/C22H31N5O4/c23-20(24)16-8-6-14(7-9-16)12-26-21(30)17-10-11-27(17)22(31)19(25-13-18(28)29)15-4-2-1-3-5-15/h6-9,15,17,19,25H,1-5,10-13H2,(H3,23,24)(H,26,30)(H,28,29)/t17-,19+/m0/s1
InChIKey DKWNMCUOEDMMIN-PKOBYXMFSA-N
SMILES C1CCC(CC1)C(C(=O)N2CCC2C(=O)NCC3=CC=C(C=C3)C(=N)N)NCC(=O)O

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