Inhibitor Report for: 1,3,4-oxadiazolyl-ketone-18h
| 1,3,4-oxadiazolyl-ketone-18h | Type | Pyrrolidine |
|---|
| | Ketone |
| | Oxadiazol |
| | tert-Butyl |
| Other_Name | 13Z |
| | CHEMBL1229644 |
| Chemical_Nomenclature | [2-[(2S,4S)-2-[(R)-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-hydroxymethyl]-4-fluoropyrrolidin-1-yl]-2-oxoethyl]-(1-hydroxy-2-methylpropan-2-yl)azanium |
| Formula | C17H30FN4O4+ |
| MW | 373.44 |
|  |
| Paper | Koo_2007_Bioorg.Med.Chem.Lett_17_4167 |
| Structure | 2QKY |
| Gene_locus | human-DPP4 |
| CID | 44629523 |
| | 24851682 |
| Family | DPP4N_Peptidase_S9 |
| InChIKey | PHTMASAWZAGGEK-GMXVVIOVSA-O |
| | XRXUTQQKFLCKFJ-QWRGUYRKSA-N |
| CanonicalSMILES | CC(C)(C)C1=NN=C(O1)C(C2CC(CN2C(=O)C[NH2+]C(C)(C)CO)F)O |
| InChI | InChI=1S/C17H29FN4O4/c1-16(2,3)15-21-20-14(26-15)13(25)11-6-10(18)8-22(11)12(24)7-19-17(4,5)9-23/h10-11,13,19,23,25H,6-9H2,1-5H3/p+1/t10-,11-,13+/m0/s1 |
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