CHEBI:57375 - lauroyl-CoA(4−)

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ChEBI Name lauroyl-CoA(4−)
ChEBI ID CHEBI:57375
ChEBI ASCII Name lauroyl-CoA(4-)
Definition An acyl-CoA(4−) arising from deprotonation of phosphate and diphosphate functions of lauroyl-CoA; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C33H54N7O17P3S
Net Charge -4
Average Mass 945.80500
Monoisotopic Mass 945.251
InChI InChI=1S/C33H58N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-24(42)61-17-16-35-23(41)14-15-36-31(45)28(44)33(2,3)19-54-60(51,52)57-59(49,50)53-18-22-27(56-58(46,47)48)26(43)32(55-22)40-21-39-25-29(34)37-20-38-30(25)40/h20-22,26-28,32,43-44H,4-19H2,1-3H3,(H,35,41)(H,36,45)(H,49,50)(H,51,52)(H2,34,37,38)(H2,46,47,48)/p-4/t22-,26-,27-,28+,32-/m1/s1
InChIKey YMCXGHLSVALICC-GMHMEAMDSA-J
SMILES CCCCCCCCCCCC(=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
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing lauroyl-CoA(4−) (CHEBI:57375) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
lauroyl-CoA(4−) (CHEBI:57375) has role human metabolite (CHEBI:77746)
lauroyl-CoA(4−) (CHEBI:57375) is a medium-chain fatty acyl-CoA(4−) (CHEBI:90546)
lauroyl-CoA(4−) (CHEBI:57375) is a saturated fatty acyl-CoA(4−) (CHEBI:77332)
lauroyl-CoA(4−) (CHEBI:57375) is conjugate base of lauroyl-CoA (CHEBI:15521)
Incoming 2-hydroxydodecanoyl-CoA(4−) (CHEBI:138299) has functional parent lauroyl-CoA(4−) (CHEBI:57375)
lauroyl-CoA (CHEBI:15521) is conjugate acid of lauroyl-CoA(4−) (CHEBI:57375)
IUPAC Name
3'-phosphonatoadenosine 5'-(3-{(3R)-4-[(3-{[2-(dodecanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} diphosphate)
Synonyms Sources
dodecanoyl-CoA UniProt
dodecanoyl-CoA(4-) ChEBI
dodecanoyl-coenzyme A(4-) ChEBI
lauroyl-CoA tetraanion ChEBI
lauroyl-coenzyme A(4−) ChEBI
Last Modified
21 January 2016