Molecule: butyryl-CoA(4-)
An acyl-CoA(4-) that is the tetraanion of butyryl-CoA, arising from deprotonation of phosphate and diphosphate functions.
Synonyms for butyryl-CoA(4-) :
butanoyl-CoA
butanoyl-coenzyme A(4-)
butyryl-coenzyme A tetraanion
butyryl-coenzyme A(4-)
Molecular Formula: C25H38N7O17P3S
Molecular wt: 833.59200 g/mole
Charge: -4
SMILES: CCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12
InChIKey: CRFNGMNYKDXRTN-CITAKDKDSA-J
InChI=1S/C25H42N7O17P3S/c1-4-5-16(34)53-9-8-27-15(33)6-7-28-23(37)20(36)25(2,3)11-46-52(43,44)49-51(41,42)45-10-14-19(48-50(38,39)40)18(35)24(47-14)32-13-31-17-21(26)29-12-30-22(17)32/h12-14,18-20,24,35-36H,4-11H2,1-3H3,(H,27,33)(H,28,37)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40)/p-4/t14-,18-,19-,20+,24-/m1/s1
Sample reactions for this molecule: