basic_info |
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| Product_Name： | DICLOFENAC ACYL-BETA-D-GLUCURONIDE ALLYL ESTER |
| CAS： | 698358-10-0 |
| EnglishSynonyms： | DICLOFENAC ACYL-BETA-D-GLUCURONIDE ALLYL ESTER |
| pro_mdlNumber： | MFCD23160284 |
| pro_acceptors： | 9 |
| pro_donors： | 4 |
| pro_smile： | C=CCOC(=O)[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC(=O)Cc2ccccc2Nc3c(cccc3Cl)Cl)O)O)O |
| InChi： | InChI=1S/C23H23Cl2NO8/c1-2-10-32-22(31)21-19(29)18(28)20(30)23(34-21)33-16(27)11-12-6-3-4-9-15(12)26-17-13(24)7-5-8-14(17)25/h2-9,18-21,23,26,28-30H,1,10-11H2/t18-,19-,20+,21-,23+/m0/s1 |
| InChiKey： | InChIKey=WNQJKISLWOVAQH-KHYDEXNFSA-N |
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