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Substance Name: Saxagliptin tartrate hemihydrate
RN: 1073057-37-0
UNII: M70CAB6UG6
InChIKey: IGWGVSTWGTWJRT-VBHLBGAFSA-N

Molecular Weight

  • 949.0146
 
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Names and Synonyms

Name of Substance

  • Saxagliptin tartrate hemihydrate

Synonyms

  • Saxagliptin tartrate hemihydrate
  • UNII-M70CAB6UG6

Registry Numbers

CAS Registry Number

  • 1073057-37-0

FDA UNII

  • M70CAB6UG6

System Generated Number

  • 1073057370

Structure Descriptors

InChI

1S/2C18H25N3O2.2C4H6O6.H2O/c2*19-8-13-2-12-3-14(12)21(13)16(22)15(20)17-4-10-1-11(5-17)7-18(23,6-10)9-17;2*5-1(3(7)8)2(6)4(9)10;/h2*10-15,23H,1-7,9,20H2;2*1-2,5-6H,(H,7,8)(H,9,10);1H2/t2*10?,11?,12-,13+,14+,15-,17?,18?;2*1-,2-;/m1111./s1

InChIKey

IGWGVSTWGTWJRT-VBHLBGAFSA-N

Smiles

O.N[C@H](C(=O)N1[C@@H](C[C@@H]2C[C@H]12)C#N)C34CC5CC(CC(O)(C5)C3)C4.N[C@H](C(=O)N6[C@@H](C[C@@H]7C[C@H]67)C#N)C89CC%10CC(CC(O)(C%10)C8)C9.O[C@H]([C@@H](O)C(=O)O)C(=O)O.O[C@H]([C@@H](O)C(=O)O)C(=O)O