
| CAS Number | 1256756-88-3 |
| Catalog Number | AG01EOGK(AGN-PC-3H46DA) |
| Chemical Name | Retagliptin (phosphate) |
| IUPAC Name | methyl 7-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-(trifluoromethyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-1-carboxylate;phosphoric acid |
| InChI | InChI=1S/C19H18F6N4O3.H3O4P/c1-32-17(31)16-14-8-28(2-3-29(14)18(27-16)19(23,24)25)15(30)6-10(26)4-9-5-12(21)13(22)7-11(9)20;1-5(2,3)4/h5,7,10H,2-4,6,8,26H2,1H3;(H3,1,2,3,4)/t10-;/m1./s1 |
| InChI Key | SFNHOWDAQMIJPX-HNCPQSOCSA-N |
| MDL Number | MFCD31692418 |
| Molecular Formula | C19H18F6N4O3 |
| Molecular Weight | 464.3616 |
| SMILES | O=C(C1=C2CN(C(C[C@H](N)CC3=CC(F)=C(F)C=C3F)=O)CCN2C(C(F)(F)F)=N1)OC |
| UNII | 24NZ3UE3DJ |
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