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CHEBI:760774 - 3'-dephospho-octanoyl-CoA(2-)
| Formula | C29H47N7O14P2S |
| Net Charge | -2 |
| Average Mass | 811.745 |
| Monoisotopic Mass | 811.23879 |
| SMILES | CCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O |
| InChI | InChI=1S/C29H49N7O14P2S/c1-4-5-6-7-8-9-20(38)53-13-12-31-19(37)10-11-32-27(42)24(41)29(2,3)15-48-52(45,46)50-51(43,44)47-14-18-22(39)23(40)28(49-18)36-17-35-21-25(30)33-16-34-26(21)36/h16-18,22-24,28,39-41H,4-15H2,1-3H3,(H,31,37)(H,32,42)(H,43,44)(H,45,46)(H2,30,33,34)/p-2/t18-,22-,23-,24+,28-/m1/s1 |
| InChIKey | IFWGPTFRXHTDPT-CECATXLMSA-L |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3'-dephospho-octanoyl-CoA(2-) (CHEBI:760774) has functional parent octanoyl-CoA(4−) (CHEBI:57386) |
| 3'-dephospho-octanoyl-CoA(2-) (CHEBI:760774) is a organophosphate oxoanion (CHEBI:58945) |
| UniProt Name | Source |
|---|---|
| 3'-dephospho-octanoyl-CoA | UniProt |