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Substance Name: Sitagliptin phosphate
RN: 654671-78-0
UNII: 494P4635I6
InChIKey: IQFYVLUXQXSJJN-SBSPUUFOSA-N

Note

  • MK-0431 is the phosphate salt of the (2R)-isomer; inhibitor of DPP4 protein resulting in enhanced level of Glucagon-Like Peptide 1.

Molecular Formula

  • C16-H15-F6-N5-O.H3-O4-P

Molecular Weight

  • 505.3102
 

Classification Code

  • Antidiabetic

Names and Synonyms

Name of Substance

  • Sitagliptin phosphate

Synonyms

  • (2R)-4-Oxo-4-(3-(trifluoromethyl)-5,6-dihydro(1,2,4)triazolo(4,3-a)pyrazin-7(8H)-yl)-1-(2,4,5-trifluorophenyl)butan-2-amine phosphate salt
  • 4-Oxo-4-(3-(trifluoromethyl)-5,6-dihydro(1,2,4)triazolo(4,3-a)pyrazin-7(8H)-yl)-1-(2,4,5-trifluorophenyl)butan-2-amine phosphate
  • Januvia
  • MK 0431
  • MK 431
  • MK-0431
  • MK0431
  • Sitagliptin phosphate
  • UNII-494P4635I6

Registry Numbers

CAS Registry Number

  • 654671-78-0

FDA UNII

  • 494P4635I6

Other Registry Number

  • 790712-60-6

System Generated Number

  • 0654671780

Structure Descriptors

InChI

1S/C16H15F6N5O.H3O4P/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22;1-5(2,3)4/h4,6,9H,1-3,5,7,23H2;(H3,1,2,3,4)/t9-;/m1./s1

InChIKey

IQFYVLUXQXSJJN-SBSPUUFOSA-N

Smiles

N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc3cc(F)c(F)cc3F.OP(=O)(O)O