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Substance Name: JTV-803
RN: 247131-79-9
UNII: 7PT6AGF1ST
InChIKey: NOBZETMXGVAWIM-UHFFFAOYSA-N

Classification Codes

  • Anticoagulants
  • Antithrombins
  • Enzyme Inhibitors
  • Factor Xa Inhibitors
  • Hematologic Agents
  • Protease Inhibitors
  • Serine Proteinase Inhibitors

Molecular Formula

  • C22-H27-N5-O3.C-H4-O3-S

Molecular Weight

  • 505.5929
 
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Names and Synonyms

Name of Substance

  • JTV-803

Synonyms

  • 4-Piperidinecarboxylic acid, 4-(((2-(aminoiminomethyl)-1,2,3,4-tetrahydro-7-isoquinolinyl)oxy)methyl)-1-(4-pyridinyl)-, methanesulfonate (1:1)
  • 4-Piperidinecarboxylic acid, 4-(((2-(aminoiminomethyl)-1,2,3,4-tetrahydro-7-isoquinolinyl)oxy)methyl)-1-(4-pyridinyl)-, monomethanesulfonate
  • JTV-803
  • UNII-7PT6AGF1ST

Registry Numbers

CAS Registry Number

  • 247131-79-9

FDA UNII

  • 7PT6AGF1ST

System Generated Number

  • 0247131799

Structure Descriptors

InChI

1S/C22H27N5O3.CH4O3S/c23-21(24)27-10-5-16-1-2-19(13-17(16)14-27)30-15-22(20(28)29)6-11-26(12-7-22)18-3-8-25-9-4-18;1-5(2,3)4/h1-4,8-9,13H,5-7,10-12,14-15H2,(H3,23,24)(H,28,29);1H3,(H,2,3,4)

InChIKey

NOBZETMXGVAWIM-UHFFFAOYSA-N

Smiles

CS(=O)(=O)O.c1cc2c(cc1OCC3(CCN(CC3)c4ccncc4)C(=O)O)CN(CC2)C(=N)N