CHEBI:15532 - myristoyl-CoA

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name myristoyl-CoA
ChEBI ID CHEBI:15532
Definition A long-chain fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of myristic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter kieran
Secondary ChEBI IDs CHEBI:52969, CHEBI:15218, CHEBI:14637, CHEBI:26898, CHEBI:9475
Supplier Information ZINC000008216889
Download Molfile XML SDF
Formula C35H62N7O17P3S
Net Charge 0
Average Mass 977.89104
Monoisotopic Mass 977.31358
InChI InChI=1S/C35H62N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-26(44)63-19-18-37-25(43)16-17-38-33(47)30(46)35(2,3)21-56-62(53,54)59-61(51,52)55-20-24-29(58-60(48,49)50)28(45)34(57-24)42-23-41-27-31(36)39-22-40-32(27)42/h22-24,28-30,34,45-46H,4-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)/t24-,28-,29-,30+,34-/m1/s1
InChIKey DUAFKXOFBZQTQE-QSGBVPJFSA-N
SMILES CCCCCCCCCCCCCC(=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
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Escherichia coli (NCBI:txid562) See: PubMed
Roles Classification
Chemical Role(s): acyl donor
Any donor that can transfer acyl groups between molecular entities.
(via acyl-CoA )
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing myristoyl-CoA (CHEBI:15532) has functional parent coenzyme A (CHEBI:15346)
myristoyl-CoA (CHEBI:15532) has functional parent tetradecanoic acid (CHEBI:28875)
myristoyl-CoA (CHEBI:15532) has role Escherichia coli metabolite (CHEBI:76971)
myristoyl-CoA (CHEBI:15532) has role mouse metabolite (CHEBI:75771)
myristoyl-CoA (CHEBI:15532) is a 11,12-saturated fatty acyl-CoA (CHEBI:85348)
myristoyl-CoA (CHEBI:15532) is a long-chain fatty acyl-CoA (CHEBI:33184)
myristoyl-CoA (CHEBI:15532) is a saturated fatty acyl-CoA (CHEBI:231546)
myristoyl-CoA (CHEBI:15532) is conjugate acid of myristoyl-CoA(4−) (CHEBI:57385)
Incoming (S)-3-hydroxytetradecanoyl-CoA (CHEBI:27466) has functional parent myristoyl-CoA (CHEBI:15532)
3-oxotetradecanoyl-CoA (CHEBI:28726) has functional parent myristoyl-CoA (CHEBI:15532)
myristoyl-CoA(4−) (CHEBI:57385) is conjugate base of myristoyl-CoA (CHEBI:15532)
IUPAC Name
3'-phosphoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[(3-oxo-3-{[2-(tetradecanoylsulfanyl)ethyl]amino}propyl)amino]butyl} dihydrogen diphosphate)
Synonyms Sources
Myristoyl-CoA KEGG COMPOUND
n-C14:0-CoA ChEBI
n-C14:0-coenzyme A ChEBI
S-tetradecanoyl-coenzyme A ChEBI
Tetradecanoyl-CoA KEGG COMPOUND
Manual Xrefs Databases
C02593 KEGG COMPOUND
DB02180 DrugBank
HMDB0001521 HMDB
LMFA07050008 LIPID MAPS
MYA PDBeChem
View more database links
Registry Numbers Types Sources
3130-72-1 CAS Registry Number ChemIDplus
8033632 Reaxys Registry Number Reaxys
Citations
Last Modified
07 June 2024