basic_info |
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| Product_Name: | ADENOSINE 3'-PHOSPHATE 5'-PHOSPHOSULFATE, TETRALITHIUM SALT |
| CAS: | 102029-54-9 |
| EnglishSynonyms: | PAPS, 4LI ; ADENOSINE 3'-PHOSPHATE 5'-PHOSPHOSULFATE, TETRALITHIUM SALT |
| pro_mdlNumber: | MFCD02094723 |
| pro_acceptors: | 18 |
| pro_donors: | 2 |
| pro_smile: | [Li+].[Li+].[Li+].[Li+].c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)COS(=O)(=O)OP(=O)([O-])[O-])OP(=O)([O-])[O-])O)N |
| InChi: | InChI=1S/C10H15N5O13P2S.4Li/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7(27-29(17,18)19)4(26-10)1-25-31(23,24)28-30(20,21)22;;;;/h2-4,6-7,10,16H,1H2,(H2,11,12,13)(H2,17,18,19)(H2,20,21,22);;;;/q;4*+1/p-4/t4-,6-,7-,10-;;;;/m1..../s1 |
| InChiKey: | InChIKey=XWIJNPMPIUNGDA-KWIZKVQNSA-J |
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