basic_info |
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| Product_Name: | DABIGATRAN ACYL GLUCURONIDE |
| EnglishSynonyms: | DABIGATRAN ACYL GLUCURONIDE |
| pro_mdlNumber: | MFCD21363575 |
| pro_acceptors: | 16 |
| pro_donors: | 7 |
| pro_smile: | Cn1c2ccc(cc2nc1CNc3ccc(cc3)C(=N)N)C(=O)N(CCC(=O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)c5ccccn5 |
| InChi: | InChI=1S/C31H33N7O9/c1-37-20-10-7-17(14-19(20)36-22(37)15-35-18-8-5-16(6-9-18)28(32)33)29(43)38(21-4-2-3-12-34-21)13-11-23(39)46-31-26(42)24(40)25(41)27(47-31)30(44)45/h2-10,12,14,24-27,31,35,40-42H,11,13,15H2,1H3,(H3,32,33)(H,44,45)/t24-,25-,26+,27-,31+/m0/s1 |
| InChiKey: | InChIKey=CSZFDMHIDSUHPI-KWONYSJQSA-N |
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