basic_info |
|
| Product_Name： | ADECHLORIN |
| CAS： | 96328-17-5 |
| EnglishSynonyms： | ADECHLORIN |
| pro_mdlNumber： | MFCD09838126 |
| pro_acceptors： | 8 |
| pro_donors： | 4 |
| pro_smile： | c1nc2c(n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)Cl)NC=NC[C@H]2O |
| InChi： | InChI=1S/C11H15ClN4O4/c12-7-9(19)6(2-17)20-11(7)16-4-15-8-5(18)1-13-3-14-10(8)16/h3-7,9,11,17-19H,1-2H2,(H,13,14)/t5-,6-,7-,9-,11-/m1/s1 |
| InChiKey： | InChIKey=JYWSHPMZFVPRRF-AMFMTJJISA-N |
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