| Compound-ID | 11900 |
| Common Name | 2-Ketocyclohexane-1-carboxyl-CoA |
| Synonyms |
2-Oxocyclohexane-1-carbonyl-CoA
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| InChI |
InChI=1S/C28H44N7O18P3S/c1-28(2,22(39)25(40)31-8-7-18(37)30-9-10-57-27(41)15-5-3-4-6-16(15)36)12-50-56(47,48)53-55(45,46)49-11-17-21(52-54(42,43)44)20(38)26(51-17)35-14-34-19-23(29)32-13-33-24(19)35/h13-15,17,20-22,26,38-39H,3-12H2,1-2H3,(H,30,37)(H,31,40)(H,45,46)(H,47,48)(H2,29,32,33)(H2,42,43,44)/t15?,17-,20-,21-,22+,26-/m1/s1
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| 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)C4CCCCC4(=O)
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| External Links | |
| KEGG-COMPOUND-ID |
C09813
|
| PUBCHEM-ID | 12001 |
| ChEBI-ID |
27664
|
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View all entries for compound: 2-Ketocyclohexane-1-carboxyl-CoA |