基本信息 |
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产品名称: | 洋艾素 |
CAS: | 1362-42-1 |
中文同义词: | 洋艾素 |
英文同义词: | ABSINTHIN ; ABSYNTHIN |
MDL号: | MFCD00272148 |
氢键受体数量: | 6 |
氢键供体数量: | 2 |
Smile: | C[C@H]1[C@@H]2CC[C@]([C@@H]3[C@H]4[C@H]5C=C([C@@]6([C@H]4C(=C3[C@H]2OC1=O)C)[C@@H]5[C@@](CC[C@@H]7[C@@H]6OC(=O)[C@H]7C)(C)O)C)(C)O |
InChi: | InChI=1S/C30H40O6/c1-12-11-18-20-21(30(12)24(18)29(6,34)10-8-17-14(3)27(32)36-25(17)30)15(4)19-22(20)28(5,33)9-7-16-13(2)26(31)35-23(16)19/h11,13-14,16-18,20-25,33-34H,7-10H2,1-6H3/t13-,14-,16-,17-,18+,20-,21-,22-,23-,24-,25-,28-,29-,30+/m0/s1 |
InChiKey: | InChIKey=PZHWYURJZAPXAN-ILOFNVQHSA-N |
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