basic_info |
|
| Product_Name： | 1-ALLYLELYMOCLAVINE |
| CAS： | 91897-48-2 |
| EnglishSynonyms： | 1-ALLYLELYMOCLAVINE |
| pro_mdlNumber： | MFCD01729217 |
| pro_acceptors： | 3 |
| pro_donors： | 1 |
| pro_smile： | CN1CC(=C[C@H]2[C@H]1Cc3cn(c4c3c2ccc4)CC=C)CO |
| InChi： | InChI=1S/C19H22N2O/c1-3-7-21-11-14-9-18-16(8-13(12-22)10-20(18)2)15-5-4-6-17(21)19(14)15/h3-6,8,11,16,18,22H,1,7,9-10,12H2,2H3/t16-,18-/m1/s1 |
| InChiKey： | InChIKey=INGYAWPTEWYFHI-SJLPKXTDSA-N |
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