basic_info |
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| Product_Name: | 1,N6-ETHENOACETYL COENZYME A LITHIUM SALT |
| EnglishSynonyms: | 1,N6-ETHENOACETYL COENZYME A LITHIUM SALT |
| pro_mdlNumber: | MFCD00056764 |
| pro_acceptors: | 23 |
| pro_donors: | 4 |
| pro_smile: | [Li+].[Li+].[Li+].[Li+].CC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncn4c3ncc4)O)OP(=O)([O-])[O-])C(C(=O)NCCC(=O)NCCS)O |
| InChi: | InChI=1S/C23H36N7O16P3S.4Li/c1-23(2,18(33)21(34)26-4-3-14(31)24-6-8-50)10-43-49(40,41)46-48(38,39)42-9-13-17(45-47(35,36)37)16(32)22(44-13)30-12-27-15-19-25-5-7-29(19)11-28-20(15)30;;;;/h5,7,11-13,16-18,22,32-33,50H,3-4,6,8-10H2,1-2H3,(H,24,31)(H,26,34)(H,38,39)(H,40,41)(H2,35,36,37);;;;/q;4*+1/p-4/t13-,16-,17-,18?,22-;;;;/m1..../s1 |
| InChiKey: | InChIKey=NJGMQKMCZKQWBH-JXGVRESCSA-J |
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