basic_info |
|
| Product_Name: | SF1126 |
| CAS: | 936487-67-1 |
| EnglishSynonyms: | SF1126 |
| pro_mdlNumber: | MFCD16038908 |
| pro_acceptors: | 22 |
| pro_donors: | 9 |
| pro_smile: | c1ccc(cc1)c2cccc3c2oc(cc3=O)[N+]4(CCOCC4)COC(=O)CCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)[O-] |
| InChi: | InChI=1S/C39H48N8O14/c40-39(41)42-13-5-10-26(36(55)43-20-31(51)45-27(18-33(52)53)37(56)46-28(21-48)38(57)58)44-30(50)11-12-34(54)60-22-47(14-16-59-17-15-47)32-19-29(49)25-9-4-8-24(35(25)61-32)23-6-2-1-3-7-23/h1-4,6-9,19,26-28,48H,5,10-18,20-22H2,(H9-,40,41,42,43,44,45,46,50,51,52,53,55,56,57,58)/t26-,27-,28-/m0/s1 |
| InChiKey: | InChIKey=SVNJBEMPMKWDCO-KCHLEUMXSA-N |
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