basic_info |
|
| Product_Name： | 硫辛酸硫胺 |
| CAS： | 137-86-0 |
| 中文同义词： | 硫辛酸硫胺 |
| EnglishSynonyms： | OCTOTIAMINE |
| pro_mdlNumber： | MFCD01711120 |
| pro_acceptors： | 9 |
| pro_donors： | 2 |
| pro_smile： | Cc1ncc(c(n1)N)CN(C=O)/C(=C(\CCO)/SSCCC(CCCCC(=O)OC)SC(=O)C)/C |
| InChi： | InChI=1S/C23H36N4O5S3/c1-16(27(15-29)14-19-13-25-17(2)26-23(19)24)21(9-11-28)35-33-12-10-20(34-18(3)30)7-5-6-8-22(31)32-4/h13,15,20,28H,5-12,14H2,1-4H3,(H2,24,25,26)/b21-16+ |
| InChiKey： | InChIKey=VJTXQHYNRDGLON-LTGZKZEYSA-N |
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