CHEBI:65052 - tetracosanoyl-CoA(4−)

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ChEBI Name tetracosanoyl-CoA(4−)
ChEBI ID CHEBI:65052
ChEBI ASCII Name tetracosanoyl-CoA(4-)
Definition A saturated fatty acyl-CoA(4−) oxoanion arising from deprotonation of the phosphate and diphosphate OH groups of tetracosanoyl-CoA. The major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter AnneNiknejad
Supplier Information
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Formula C45H78N7O17P3S
Net Charge -4
Average Mass 1114.12400
Monoisotopic Mass 1113.44097
InChI InChI=1S/C45H82N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-36(54)73-29-28-47-35(53)26-27-48-43(57)40(56)45(2,3)31-66-72(63,64)69-71(61,62)65-30-34-39(68-70(58,59)60)38(55)44(67-34)52-33-51-37-41(46)49-32-50-42(37)52/h32-34,38-40,44,55-56H,4-31H2,1-3H3,(H,47,53)(H,48,57)(H,61,62)(H,63,64)(H2,46,49,50)(H2,58,59,60)/p-4/t34-,38-,39-,40+,44-/m1/s1
InChIKey MOYMQYZWIUKGGY-JBKAVQFISA-J
SMILES CCCCCCCCCCCCCCCCCCCCCCCC(=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
ChEBI Ontology
Outgoing tetracosanoyl-CoA(4−) (CHEBI:65052) is a 3-substituted propionyl-CoA(4−) (CHEBI:65111)
tetracosanoyl-CoA(4−) (CHEBI:65052) is a saturated fatty acyl-CoA(4−) (CHEBI:77332)
tetracosanoyl-CoA(4−) (CHEBI:65052) is a very long-chain acyl-CoA(4−) (CHEBI:90736)
tetracosanoyl-CoA(4−) (CHEBI:65052) is conjugate base of tetracosanoyl-CoA (CHEBI:52974)
Incoming tetracosanoyl-CoA (CHEBI:52974) is conjugate acid of tetracosanoyl-CoA(4−) (CHEBI:65052)
IUPAC Name
3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-({2-[(tetracosanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}butyl] diphosphate}
Synonyms Sources
C24:0-CoA(4−) ChEBI
C24:0-coenzyme A(4−) ChEBI
lignoceroyl-CoA(4−) ChEBI
tetracosanoyl-CoA UniProt
tetracosanoyl-CoA (4-) ChEBI
tetracosanoyl-coenzyme A(4−) ChEBI
Last Modified
13 March 2017