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| Product_Name: | (5Z,8Z,11Z,14Z,17Z-EICOSAPENTAENOYL) COENZYME A AMMONIUM SALT |
| CAS: | 1246522-05-3 |
| EnglishSynonyms: | (5Z,8Z,11Z,14Z,17Z-EICOSAPENTAENOYL) COENZYME A AMMONIUM SALT ; 20:5 COENZYME A AMMONIUM SALT ; (5Z,8Z,11Z,14Z,17Z-EICOSAPENTAENOYL) COENZYME A (AMMONIUM SALT) |
| pro_mdlNumber: | MFCD22416940 |
| pro_acceptors: | 24 |
| pro_donors: | 6 |
| pro_smile: | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)OP(=O)(O)[O-])O.[NH4+].[NH4+].[NH4+] |
| InChi: | InChI=1S/C41H64N7O17P3S.3H3N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32(50)69-25-24-43-31(49)22-23-44-39(53)36(52)41(2,3)27-62-68(59,60)65-67(57,58)61-26-30-35(64-66(54,55)56)34(51)40(63-30)48-29-47-33-37(42)45-28-46-38(33)48;;;/h5-6,8-9,11-12,14-15,17-18,28-30,34-36,40,51-52H,4,7,10,13,16,19-27H2,1-3H3,(H,43,49)(H,44,53)(H,57,58)(H,59,60)(H2,42,45,46)(H2,54,55,56);3*1H3/b6-5-,9-8-,12-11-,15-14-,18-17-;;;/t30-,34-,35-,36+,40-;;;/m1.../s1 |
| InChiKey: | InChIKey=QCDQAUBOSVTHRQ-RWZJTUFVSA-N |
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