basic_info |
|
| Product_Name： | BUTTPARK 108\40-71 |
| EnglishSynonyms： | BUTTPARK 108\40-71 |
| pro_mdlNumber： | MFCD05883213 |
| pro_acceptors： | 9 |
| pro_donors： | 2 |
| pro_smile： | c1cc2c(cc1/N=N/c3c4[nH]c5c(c(=O)n4[nH]c3=O)CCC5)OCO2 |
| InChi： | InChI=1S/C16H13N5O4/c22-15-13(19-18-8-4-5-11-12(6-8)25-7-24-11)14-17-10-3-1-2-9(10)16(23)21(14)20-15/h4-6,17H,1-3,7H2,(H,20,22)/b19-18+ |
| InChiKey： | InChIKey=QYVXOQTTZHPPCI-VHEBQXMUSA-N |
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