basic_info |
|
| Product_Name： | PLOMESTANE |
| CAS： | 77016-85-4 |
| EnglishSynonyms： | PLOMESTANE |
| pro_mdlNumber： | MFCD00866238 |
| pro_acceptors： | 2 |
| pro_donors： | 0 |
| pro_smile： | C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)CC[C@]34CC#C |
| InChi： | InChI=1S/C21H26O2/c1-3-10-21-12-8-15(22)13-14(21)4-5-16-17-6-7-19(23)20(17,2)11-9-18(16)21/h1,13,16-18H,4-12H2,2H3/t16-,17-,18-,20-,21-/m0/s1 |
| InChiKey： | InChIKey=JKPDEYAOCSQBSZ-OEUJLIAZSA-N |
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