basic_info |
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| Product_Name： | 4-反式-(4-庚基环己基苯甲酸)对庚基苯酚酯 |
| CAS： | 84601-00-3 |
| 中文同义词： | 21-氨基-17-羟基黄体酮盐酸 ; 4-反式-(4-庚基环己基苯甲酸)对庚基苯酚酯 |
| EnglishSynonyms： | 4-HEPTYLPHENYL 4-TRANS-(4-HEPTYLCYCLOHEXYL)BENZOATE ; 4-HEPTYLPHENYL-4'-TRANS-HEPTYLCYCLOHEXYLBENZOATE |
| pro_mdlNumber： | MFCD09952991 |
| pro_acceptors： | 2 |
| pro_donors： | 0 |
| pro_smile： | CCCCCCCc1ccc(cc1)OC(=O)c2ccc(cc2)[C@H]3CC[C@@H](CC3)CCCCCCC |
| InChi： | InChI=1S/C33H48O2/c1-3-5-7-9-11-13-27-15-19-29(20-16-27)30-21-23-31(24-22-30)33(34)35-32-25-17-28(18-26-32)14-12-10-8-6-4-2/h17-18,21-27,29H,3-16,19-20H2,1-2H3/t27-,29- |
| InChiKey： | InChIKey=SMCWOLNRUGDXNY-KWQFAZJVSA-N |
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