Compound Details

 Compound-ID 7782
 Common Name 2-Amino-5-oxocyclohex-1-enecarbonyl-CoA
 Synonyms 2-Amino-5-oxo-cyclohex-1-enecarboxy-CoA
 InChI InChI=1S/C28H43N8O18P3S/c1-28(2,22(40)25(41)32-6-5-18(38)31-7-8-58-27(42)15-9-14(37)3-4-16(15)29)11-51-57(48,49)54-56(46,47)50-10-17-21(53-55(43,44)45)20(39)26(52-17)36-13-35-19-23(30)33-12-34-24(19)36/h12-13,17,20-22,26,39-40H,3-11,29H2,1-2H3,(H,31,38)(H,32,41)(H,46,47)(H,48,49)(H2,30,33,34)(H2,43,44,45)/t17-,20-,21-,22+,26-/m1/s1
 SMILES CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1(OP(O)(O)=O))n3cnc2c(N)ncnc23)C(O)C(=O)NCCC(=O)NCCSC(=O)C=4CC(=O)CCC=4(N)
 External Links
 KEGG-COMPOUND-ID C05165
 PUBCHEM-ID 7580
 ChEBI-ID 18206


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