basic_info |
|
| Product_Name: | EXP6803 |
| CAS: | 114773-44-3 |
| EnglishSynonyms: | EXP6803 |
| pro_mdlNumber: | MFCD00880558 |
| pro_acceptors: | 8 |
| pro_donors: | 1 |
| pro_smile: | CCCCc1nc(c(n1Cc2ccc(cc2)NC(=O)c3ccccc3C(=O)[O-])CC(=O)OC)Cl.[Na+] |
| InChi: | InChI=1S/C25H26ClN3O5.Na/c1-3-4-9-21-28-23(26)20(14-22(30)34-2)29(21)15-16-10-12-17(13-11-16)27-24(31)18-7-5-6-8-19(18)25(32)33;/h5-8,10-13H,3-4,9,14-15H2,1-2H3,(H,27,31)(H,32,33);/q;+1/p-1 |
| InChiKey: | InChIKey=QPMLWMFMSLFKBS-UHFFFAOYSA-M |
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