basic_info |
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| Product_Name: | 1,3-二噁烷,2-[2-(3-环己烯-1-基)乙基]-5,5-二甲基- |
| CAS: | 3270-35-7 |
| 中文同义词: | 1,3-二噁烷,2-[2-(3-环己烯-1-基)乙基]-5,5-二甲基- |
| EnglishSynonyms: | TETRODONIC ACID |
| pro_mdlNumber: | MFCD01682461 |
| pro_acceptors: | 11 |
| pro_donors: | 8 |
| pro_smile: | C([C@@]1([C@@H]([C@@H]2[C@H]3N=C(N[C@]2([C@H]([C@H]1O)O)[C@@H](O3)C(=O)O)N)O)O)O |
| InChi: | InChI=1S/C11H17N3O8/c12-9-13-7-2-3(16)10(21,1-15)4(17)5(18)11(2,14-9)6(22-7)8(19)20/h2-7,15-18,21H,1H2,(H,19,20)(H3,12,13,14)/t2-,3-,4-,5+,6+,7+,10+,11-/m1/s1 |
| InChiKey: | InChIKey=MWPMJZZQPDXVJT-JTUKEBEQSA-N |
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