basic_info |
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Product_Name: | N,N,N'-三甲基-N'-(2-羟基-3-甲基-5-碘苯甲基)-1,3-丙二胺二盐酸 |
CAS: | 84953-77-5 |
中文同义词: | N,N,N'-三甲基-N'-(2-羟基-3-甲基-5-碘苯甲基)-1,3-丙二胺二盐酸 |
EnglishSynonyms: | VASOPRESSIN METABOLITE NEUROPEPTIDE |
pro_mdlNumber: | MFCD00080172 |
pro_acceptors: | 22 |
pro_donors: | 12 |
pro_smile: | C1C[C@H](N(C1)C(=O)[C@H](CSSC[C@@H](C(=O)O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N |
InChi: | InChI=1S/C28H46N12O10S2/c29-13(27(49)50)11-51-52-12-17(39-24(46)16(9-19(30)41)38-23(45)15-5-6-21(43)36-15)26(48)40-8-2-4-18(40)25(47)37-14(3-1-7-34-28(32)33)22(44)35-10-20(31)42/h13-18H,1-12,29H2,(H2,30,41)(H2,31,42)(H,35,44)(H,36,43)(H,37,47)(H,38,45)(H,39,46)(H,49,50)(H4,32,33,34)/t13-,14-,15-,16-,17-,18-/m0/s1 |
InChiKey: | InChIKey=ACRRQMLBQULNCV-QQCJEOGWSA-N |
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