Dapagliflozin
http://www.google.co.in/patents/US6515117
HPLC retention time: 7.08 min, 94% pure, YMC S5 C-18 4.6×50 mm column, 2.5 mL/min, detection at 220 nM; 8 min gradient 0-100% B hold 5 min at 100% B. Solvent A: 10% MeOH/H2O+0.2% H3PO4. Solvent B: 90% MeOH/H2O+0.2% H3PO4.
1H NMP (500 MHz, CD3OD) δ7.33 (d, 1H, J=6 Hz), 7.31 (d, 1H, J=2.2 Hz), 7.31 (dd, 1H, J=6 Hz, J=2.2 Hz), 7.07 (d, 2H, J=8.8 Hz), 6.78 (d, 2H, J=8.8 Hz), 4.07-3.90 (m, 7H), 3.85 (d, 1H, J=10.6 Hz), 3.69 (dd, 1H, J=5.3, 10.6 Hz), 3.42-3.25 (m, 4H) Hz), 1.34 (t, 3H, J=7 Hz).
13C NMP (125 MHz, CD3OD) δ158.8, 140.0, 139.9, 134.4, 132.9, 131.9, 130.8, 130.1, 128.2, 115.5, 82.9, 82.2, 79.7, 76.4, 71.9, 64.5, 63.1, 39.2, 15.2.
Anal Calcd for C21H25ClO6 LC-MS [M+Na+]431; found 431.
 | |
| Systematic (IUPAC) name | |
|---|---|
| (2S,3R,4R,5S,6R)-2-[4-chloro-3-(4-ethoxybenzyl)phenyl]-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol | |
| Clinical data | |
| Trade names | Forxiga, Farxiga |
| AHFS/Drugs.com | UK Drug Information |
| Licence data | EMA:Link, US FDA:link |
| Pregnancy cat. |
|
| Legal status | |
| Routes | Oral |
| Identifiers | |
| CAS number | 461432-26-8  |
| ATC code | A10BX09 |
| PubChem | CID 9887712 |
| ChemSpider | 8063384  |
| UNII | 1ULL0QJ8UC |
| ChEMBL | CHEMBL429910 |
| Synonyms | BMS-512148 |
| Chemical data | |
| Formula | C21H25ClO6 |
| Mol. mass | 408.873 g/mol |
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