basic_info |
|
| Product_Name: | TRIDECAPRENYL-MPDA |
| EnglishSynonyms: | TRIDECAPRENYL-MPDA |
| pro_mdlNumber: | MFCD02258100 |
| pro_acceptors: | 4 |
| pro_donors: | 0 |
| pro_smile: | CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/COP(=O)([O-])[O-])/C)/C)/C)/C)/C)/C)/C)/C)/C)/C)/C)/C)C.[NH4+].[NH4+] |
| InChi: | InChI=1S/C65H107O4P.2H3N/c1-53(2)27-15-28-54(3)29-16-30-55(4)31-17-32-56(5)33-18-34-57(6)35-19-36-58(7)37-20-38-59(8)39-21-40-60(9)41-22-42-61(10)43-23-44-62(11)45-24-46-63(12)47-25-48-64(13)49-26-50-65(14)51-52-69-70(66,67)68;;/h27,29,31,33,35,37,39,41,43,45,47,49,51H,15-26,28,30,32,34,36,38,40,42,44,46,48,50,52H2,1-14H3,(H2,66,67,68);2*1H3/b54-29+,55-31+,56-33+,57-35+,58-37+,59-39+,60-41+,61-43+,62-45+,63-47+,64-49+,65-51+;; |
| InChiKey: | InChIKey=LSBKKSXTKLTRPL-LFBGCEPQSA-N |
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