basic_info |
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Product_Name: | SCUTEBARBATINE Z |
CAS: | 1312716-28-1 |
EnglishSynonyms: | SCUTEBARBATINE Z |
pro_mdlNumber: | MFCD20274637 |
pro_acceptors: | 6 |
pro_donors: | 1 |
pro_smile: | C[C@@H]1[C@H]([C@@H]([C@@]2([C@@H]([C@@]1(C)CCC3=CC(=O)OC3)CCC=C2C)C)OC(=O)c4cccnc4)O |
InChi: | InChI=1S/C26H33NO5/c1-16-7-5-9-20-25(3,11-10-18-13-21(28)31-15-18)17(2)22(29)23(26(16,20)4)32-24(30)19-8-6-12-27-14-19/h6-8,12-14,17,20,22-23,29H,5,9-11,15H2,1-4H3/t17-,20-,22-,23+,25+,26+/m1/s1 |
InChiKey: | InChIKey=CWCLIHAOVIAUGY-BAMVNRKBSA-N |
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