CHEBI:66957 - 3,5,7-trioxododecanoyl-CoA(4−)

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ChEBI Name 3,5,7-trioxododecanoyl-CoA(4−) ChEBI ID CHEBI:66957 ChEBI ASCII Name 3,5,7-trioxododecanoyl-CoA(4-) Definition An acyl-CoA(4−) obtained by deprotonation of the phosphate and diphosphate OH groups of 3,5,7-trioxododecanoyl-CoA; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter KAX Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C33H48N7O20P3S Net Charge -4 Average Mass 987.75500 Monoisotopic Mass 987.19096 InChI InChI=1S/C33H52N7O20P3S/c1-4-5-6-7-19(41)12-20(42)13-21(43)14-24(45)64-11-10-35-23(44)8-9-36-31(48)28(47)33(2,3)16-57-63(54,55)60-62(52,53)56-15-22-27(59-61(49,50)51)26(46)32(58-22)40-18-39-25-29(34)37-17-38-30(25)40/h17-18,22,26-28,32,46-47H,4-16H2,1-3H3,(H,35,44)(H,36,48)(H,52,53)(H,54,55)(H2,34,37,38)(H2,49,50,51)/p-4/t22-,26-,27-,28+,32-/m1/s1 InChIKey VHFNTMSJVWRHBO-GMHMEAMDSA-J SMILES CCCCCC(=O)CC(=O)CC(=O)CC(=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 Roles Classification Chemical Role(s): acyl donor Any donor that can transfer acyl groups between molecular entities. (via acyl-CoA ) View more via ChEBI Ontology ChEBI Ontology Outgoing 3,5,7-trioxododecanoyl-CoA(4−) (CHEBI:66957) is a acyl-CoA(4−) (CHEBI:58342) 3,5,7-trioxododecanoyl-CoA(4−) (CHEBI:66957) is a medium-chain fatty acyl-CoA(4−) (CHEBI:90546) 3,5,7-trioxododecanoyl-CoA(4−) (CHEBI:66957) is a oxo-fatty acyl-CoA (CHEBI:61903) 3,5,7-trioxododecanoyl-CoA(4−) (CHEBI:66957) is conjugate base of 3,5,7-trioxododecanoyl-CoA (CHEBI:67089) Incoming 3,5,7-trioxododecanoyl-CoA (CHEBI:67089) is conjugate acid of 3,5,7-trioxododecanoyl-CoA(4−) (CHEBI:66957) Synonyms Sources 3,5,7-trioxododecanoyl-CoA UniProt 3,5,7-trioxododecanoyl-coenzyme A(4−) ChEBI 3,5,7-trioxolauroyl-CoA(4−) ChEBI 3,5,7-trioxolauroyl-coenzyme A(4−) ChEBI Citation Type Source 22802619 PubMed citation SUBMITTER Last Modified 09 December 2015