(5Z,8Z,11Z,14Z,17Z-EICOSAPENTAENOYL) COENZYME A AMMONIUM SALT

pro_cas
1246522-05-3
pro_cdbregno
CCD07395896
pro_formula
C41 H61 N7 O17 P3 S . 3 H4 N
pro_molWeight
1103.07

basic_info

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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