Chemical Compound

Vildagliptin metabolite M20.2

CAS Registry Number 1147403-03-9
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Vildagliptin metabolite M20.2 chemical structure
Primary Record

Vildagliptin metabolite M20.2

In stock
8,982 g
Purity
98.9 %
CAS
1147403-03-9

Compound Identifiers & Properties

CAS
1147403-03-9
PubChem CID
59525129
SMILES
C1C[C@H](N(C1)C(=O)CNC23CC4CC(C2)CC(C4)(C3)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)C#N
Canonical SMILES
N#C[C@@H]1CCCN1C(=O)CNC12CC3CC(C1)CC(O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)(C3)C2

Names & Synonyms

  • Vildagliptin metabolite M20.2
  • UNII-4EBB929B32
  • 4EBB929B32
  • Vildagliptin ?-D-Glucuronide
  • Vildagliptin-beta-D-glucuronide
  • SCHEMBL12013892
  • C23H33N3O8
  • 1147403-03-9
  • 3-((2-((2S)-2-Cyano-1-pyrrolidinyl)-2-oxoethyl)amino)tricyclo(3.3.1.13,7)dec-1-yl beta-D-glucopyranosiduronic acid
  • beta-D-Glucopyranosiduronic acid, 3-((2-((2S)-2-cyano-1-pyrrolidinyl)-2-oxoethyl)amino)tricyclo(3.3.1.13,7)dec-1-yl
  • (2S,3S,4S,5R,6S)-6-[[3-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxo-ethyl]amino]-1-adamantyl]oxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
  • .BETA.-D-GLUCOPYRANOSIDURONIC ACID, 3-((2-((2S)-2-CYANO-1-PYRROLIDINYL)-2-OXOETHYL)AMINO)TRICYCLO(3.3.1.13,7)DEC-1-YL
  • 3-((2-((2S)-2-CYANO-1-PYRROLIDINYL)-2-OXOETHYL)AMINO)TRICYCLO(3.3.1.13,7)DEC-1-YL .BETA.-D-GLUCOPYRANOSIDURONIC ACID