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 No supplier information found for this compound.
Download Molfile XML SDF
Formula C33H54N7O17P3S
Net Charge -4
Average Mass 945.80500
Monoisotopic Mass 945.25317
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
Manual Xref Database
LAUROYLCOA-CPD MetaCyc
View more database links
Last Modified
09 June 2021