COA
COENZYME A
Find entries where: COA
is present as a standalone ligand in 684 entries
as a non-polymer is covalently linked to polymer or other heterogen groups 86 entries
Chemical Component Summary | |
|---|---|
| Name | COENZYME A |
| Identifiers | [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-oxolan-2-yl]methyl [hydroxy-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-(2-sulfanylethylamino)propyl]amino]butoxy]phosphoryl] hydrogen phosphate |
| Formula | C21 H36 N7 O16 P3 S |
| Molecular Weight | 767.534 |
| Type | NON-POLYMER |
| Isomeric SMILES | CC(C)(CO[P@](=O)(O)O[P@@](=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)n2cnc3c2ncnc3N)O)OP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCS)O |
| InChI | InChI=1S/C21H36N7O16P3S/c1-21(2,16(31)19(32)24-4-3-12(29)23-5-6-48)8-41-47(38,39)44-46(36,37)40-7-11-15(43-45(33,34)35)14(30)20(42-11)28-10-27-13-17(22)25-9-26-18(13)28/h9-11,14-16,20,30-31,48H,3-8H2,1-2H3,(H,23,29)(H,24,32)(H,36,37)(H,38,39)(H2,22,25,26)(H2,33,34,35)/t11-,14-,15-,16+,20-/m1/s1 |
| InChIKey | RGJOEKWQDUBAIZ-IBOSZNHHSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 84 |
| Chiral Atom Count | 7 |
| Bond Count | 86 |
| Aromatic Bond Count | 10 |
Drug Info: DrugBank
| DrugBank ID | DB01992? |
|---|---|
| Name | Coenzyme A |
| Groups |
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| Description | Coenzyme A (CoA, CoASH, or HSCoA) is a coenzyme, well known for it's role in the synthesis and oxidation of fatty acids, and the oxidation of pyruvate in the citric acid cycle. All genomes sequenced to date encode enzymes that use coenzyme A as a substrate, and around 4% of cellular enzymes use it, or a thioester form of it, as a substrate. It is used as a supplement for the hypothetical treatment of acne. |
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| Categories |
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| CAS number | 85-61-0 |
Drug Targets
| Name | Target Sequence | Pharmacological Action | Actions |
|---|---|---|---|
| Galactoside O-acetyltransferase | MNMPMTERIRAGKLFTDMCEGLPEKRLRGKTLMYEFNHSHPSEVEKRESL... | unknown | |
| 3-hydroxy-3-methylglutaryl-coenzyme A reductase | MLSRLFRMHGLFVASHPWEVIVGTVTLTICMMSMNMFTGNNKICGWNYEC... | unknown | |
| Fatty acid metabolism regulator protein | MVIKAQSPAGFAEEYIIESIWNNRFPPGTILPAERELSELIGVTRTTLRE... | unknown | |
| Histone acetyltransferase KAT5 | MAEVGEIIEGCRLPVLRRNQDNEDEWPLAEILSVKDISGRKLFYVHYIDF... | unknown | |
| 2,3,4,5-tetrahydropyridine-2,6-dicarboxylate N-succinyltransferase | MQQLQNVIESAFERRADITPANVDTVTREAVNQVIGLLDSGALRVAEKID... | unknown | |
| View More | |||
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison
T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS.
Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682
Related Resource References
| Resource Name | Reference |
|---|---|
| Pharos | CHEMBL1213327 |
| PubChem | 87642 |
| ChEMBL | CHEMBL1213327 |
| ChEBI | CHEBI:15346 |
