940002-59-5
940002-59-5 structure
- Name: (–)-Sitagliptin Carbamoyl Glucuronide
- Chemical Name: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(2R)-4-oxo-4-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-1-(2,4,5-trifluorophenyl)butan-2-yl]carbamoyloxy]oxane-2-carboxylic acid
- CAS Number: 940002-59-5
- Molecular Formula: C23H23F6N5O9
- Molecular Weight: 627.44700
- Create Date: 2017-08-24 05:17:31
- Modify Date: 2024-01-14 17:04:13
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(–)-Sitagliptin carbamoyl glucuronide is a minor phase II metabolite of the dipeptidyl peptidase 4 (DPP-4) inhibitor (–)-sitagliptin
| Name | (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[[(2R)-4-oxo-4-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]-1-(2,4,5-trifluorophenyl)butan-2-yl]carbamoyloxy]oxane-2-carboxylic acid |
|---|---|
| Synonyms |
1-[N-[(1R)-3-[5,6-Dihydro-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl]-3-oxo-1-[(2,4,5-trifluorophenyl)methyl]propyl]carbamate] |A-D-Glucopyranuronic Acid
SITAGLIPTIN CARBAMOYL GLUCURONIDE Sitagliptin Carbamoyl |A-D-Glucuronide SITAGLIPTIN CARBAMOYL B-D-GLUCURONIDE |
| Density | 1.844g/cm3 |
|---|---|
| Molecular Formula | C23H23F6N5O9 |
| Molecular Weight | 627.44700 |
| Exact Mass | 627.14000 |
| PSA | 196.57000 |
| LogP | 0.00500 |
| Index of Refraction | 1.649 |