CHEBI:57392 - propionyl-CoA(4−)

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ChEBI Name propionyl-CoA(4−)
ChEBI ID CHEBI:57392
ChEBI ASCII Name propionyl-CoA(4-)
Definition Tetranion of propionyl-CoA arising from deprotonation of phosphate and diphosphate functions.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C24H36N7O17P3S
Net Charge -4
Average Mass 819.56600
InChI InChI=1S/C24H40N7O17P3S/c1-4-15(33)52-8-7-26-14(32)5-6-27-22(36)19(35)24(2,3)10-45-51(42,43)48-50(40,41)44-9-13-18(47-49(37,38)39)17(34)23(46-13)31-12-30-16-20(25)28-11-29-21(16)31/h11-13,17-19,23,34-35H,4-10H2,1-3H3,(H,26,32)(H,27,36)(H,40,41)(H,42,43)(H2,25,28,29)(H2,37,38,39)/p-4/t13-,17-,18-,19+,23-/m1/s1
InChIKey QAQREVBBADEHPA-IEXPHMLFSA-J
SMILES CCC(=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
Metabolite of Species Details
Homo sapiens (NCBI:9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing propionyl-CoA(4−) (CHEBI:57392) has role human metabolite (CHEBI:77746)
propionyl-CoA(4−) (CHEBI:57392) is a acyl-CoA(4−) (CHEBI:58342)
propionyl-CoA(4−) (CHEBI:57392) is conjugate base of propionyl-CoA (CHEBI:15539)
Incoming 3-substituted propionyl-CoA(4−) (CHEBI:65111) has functional parent propionyl-CoA(4−) (CHEBI:57392)
propionyl-CoA (CHEBI:15539) is conjugate acid of propionyl-CoA(4−) (CHEBI:57392)
IUPAC Name
3'-phosphonatoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(propanoylsulfanyl)ethyl]amino}propyl)amino]butyl} diphosphate)
Synonym Source
propanoyl-CoA UniProt
Last Modified
30 June 2014