Compound
octanoyl-CoA
An acyl-CoA(4−) that is the tetraanion of octanoyl-CoA, arising from deprotonation of phosphate and diphosphate functions.
Definition from ChEBI (CHEBI:57386), read 2026-09-23. CC BY 4.0.
Structure
No three-dimensional record for this entry.
- Class
- Organic compound, anion
- Formula
- C29H46N7O17P3S
- Mass
- 889.708 g/mol
- Charge
- -4
- InChIKey
- KQMZYOXOBSXMII-CECATXLMSA-J
- SMILES
- CCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-]
- Look it up
- ChEBIBy InChIKey
Identity from ChEBI. Not evidence.
What it touches on the way
Mechanistic reach
32 entities
32 entities reached.
0 reported hops32 assembled from the scaffold
- ACOX1ProteinUNIPROT:Q15067substrate ofInferred only60 paths15 endpoints
- ACADMProteinUNIPROT:P11310substrate ofInferred only49 paths23 endpoints
- THEM4ProteinUNIPROT:Q5T1C6substrate ofInferred only27 paths27 endpoints
- CPT1AProteinUNIPROT:P50416substrate ofInferred only26 paths26 endpoints
- HSD17B4ProteinUNIPROT:P51659substrate ofInferred only25 paths25 endpoints
- ACOX3ProteinUNIPROT:O15254substrate ofInferred only22 paths11 endpoints
- CROTProteinUNIPROT:Q9UKG9substrate ofInferred only21 paths7 endpoints
- ACAA1ProteinUNIPROT:P09110substrate ofInferred only21 paths21 endpoints
- EHHADHProteinUNIPROT:Q08426substrate ofInferred only20 paths20 endpoints
- LPCAT4ProteinUNIPROT:Q643R3substrate ofInferred only18 paths9 endpoints
- LCLAT1ProteinUNIPROT:Q6UWP7substrate ofInferred only16 paths8 endpoints
- ACOT8ProteinUNIPROT:O14734substrate ofInferred only16 paths16 endpoints
Show the remaining 20
- CPT2ProteinUNIPROT:P23786substrate ofInferred only13 paths13 endpoints
- PHYHProteinUNIPROT:O14832substrate ofInferred only13 paths13 endpoints
- ACADLProteinUNIPROT:P28330substrate ofInferred only13 paths13 endpoints
- ACOT7ProteinUNIPROT:O00154substrate ofInferred only12 paths6 endpoints
- LPCAT1ProteinUNIPROT:Q8NF37substrate ofInferred only12 paths12 endpoints
- GLYATL2ProteinUNIPROT:Q8WU03substrate ofInferred only11 paths11 endpoints
- ACAA2ProteinUNIPROT:P42765substrate ofInferred only9 paths9 endpoints
- CRATProteinUNIPROT:P43155substrate ofInferred only9 paths9 endpoints
- MECRProteinUNIPROT:Q9BV79substrate ofInferred only8 paths8 endpoints
- ACAD9ProteinUNIPROT:Q9H845substrate ofInferred only7 paths7 endpoints
- CPT1BProteinUNIPROT:Q92523substrate ofInferred only6 paths6 endpoints
- ACOT13ProteinUNIPROT:Q9NPJ3substrate ofInferred only6 paths6 endpoints
- NUDT19ProteinUNIPROT:A8MXV4substrate ofInferred only6 paths6 endpoints
- NUDT7ProteinUNIPROT:P0C024substrate ofInferred only6 paths6 endpoints
- MOGAT2ProteinUNIPROT:Q3SYC2substrate ofInferred only5 paths5 endpoints
- MOGAT1ProteinUNIPROT:Q96PD6substrate ofInferred only5 paths5 endpoints
- ACOT9ProteinUNIPROT:Q9Y305substrate ofInferred only5 paths5 endpoints
- NUDT8ProteinUNIPROT:Q8WV74substrate ofInferred only4 paths4 endpoints
- CPT1CProteinUNIPROT:Q8TCG5substrate ofInferred only4 paths4 endpoints
- MBOAT4ProteinUNIPROT:Q96T53substrate ofInferred only3 paths3 endpoints
What the reference databases state
Chemical structure
- 2-hydroxyoctanoyl-CoA has the functional parent octanoyl-CoACompoundChEBI CHEBI:138290Inferred only
Statements
59 statements
59 statements · 2 reference databases · Subject: octanoyl-CoA · Sources: Human-GEM, Rhea
- (2E)-octenoyl-CoA is converted to octanoyl-CoACompoundRhea RHEA:63232Inferred only
- octanoyl-CoA is converted to (2E)-octenoyl-CoACompoundHuman-GEM MAR02148Inferred only
- octanoyl-CoA is converted to (2E)-octenoyl-CoACompoundHuman-GEM MAR03094Inferred only
- octanoyl-CoA is converted to (2E)-octenoyl-CoACompoundHuman-GEM MAR03149Inferred only
- octanoyl-CoA is converted to (2E)-octenoyl-CoACompoundRhea RHEA:30943Inferred only
- octanoyl-CoA is converted to (2E)-octenoyl-CoACompoundRhea RHEA:40175Inferred only
- octanoyl-CoA is converted to (2E)-octenoyl-CoACompoundRhea RHEA:63232Inferred only
- (2E)-octenoyl-CoA is converted to octanoyl-CoACompoundHuman-GEM MAR02148Inferred only
- (2E)-octenoyl-CoA is converted to octanoyl-CoACompoundRhea RHEA:30943Inferred only
- (2E)-octenoyl-CoA is converted to octanoyl-CoACompoundRhea RHEA:44952Inferred only
- octanoyl-CoA is converted to 2-hydroxyoctanoyl-CoACompoundRhea RHEA:54600Inferred only
- 3-oxodecanoyl-CoA is converted to octanoyl-CoACompoundRhea RHEA:31087Inferred only
Show the remaining 47
- octanoyl-CoA is converted to octanoateCompoundRhea RHEA:51824Inferred only
- octanoyl-CoA is converted to octanoateCompoundRhea RHEA:30143Inferred only
- octanoate is converted to octanoyl-CoACompoundRhea RHEA:51824Inferred only
- octanoate is converted to octanoyl-CoACompoundRhea RHEA:33631Inferred only
- octanoyl-CoA is converted to S-octanoyl-4'-phosphopantetheineCompoundRhea RHEA:50016Inferred only
- octanoyl-CoA is a substrate of ACAA1ProteinHuman-GEM MAR06344Inferred only
- octanoyl-CoA is a substrate of ACAA2ProteinRhea RHEA:30143Inferred only
- octanoyl-CoA is a substrate of ACAD9ProteinHuman-GEM MAR03149Inferred only
- octanoyl-CoA is a substrate of ACADLProteinRhea RHEA:48180Inferred only
- octanoyl-CoA is a substrate of ACADMProteinRhea RHEA:48180Inferred only
- octanoyl-CoA is a substrate of ACADMProteinHuman-GEM MAR03149Inferred only
- octanoyl-CoA is a substrate of ACOT13ProteinRhea RHEA:30143Inferred only
- octanoyl-CoA is a substrate of ACOT7ProteinHuman-GEM MAR20170Inferred only
- octanoyl-CoA is a substrate of ACOT7ProteinRhea RHEA:30143Inferred only
- octanoyl-CoA is a substrate of ACOT8ProteinRhea RHEA:30143Inferred only
- octanoyl-CoA is a substrate of ACOT9ProteinRhea RHEA:30143Inferred only
- octanoyl-CoA is a substrate of ACOX1ProteinHuman-GEM MAR06344Inferred only
- octanoyl-CoA is a substrate of ACOX1ProteinHuman-GEM MAR03149Inferred only
- octanoyl-CoA is a substrate of ACOX1ProteinRhea RHEA:40175Inferred only
- octanoyl-CoA is a substrate of ACOX1ProteinHuman-GEM MAR03094Inferred only
- octanoyl-CoA is a substrate of ACOX3ProteinHuman-GEM MAR03094Inferred only
- octanoyl-CoA is a substrate of ACOX3ProteinHuman-GEM MAR03149Inferred only
- octanoyl-CoA is a substrate of CPT1AProteinHuman-GEM MAR03032Inferred only
- octanoyl-CoA is a substrate of CPT1BProteinHuman-GEM MAR03032Inferred only
- octanoyl-CoA is a substrate of CPT1CProteinHuman-GEM MAR03032Inferred only
- octanoyl-CoA is a substrate of CPT2ProteinRhea RHEA:17177Inferred only
- octanoyl-CoA is a substrate of CRATProteinRhea RHEA:17177Inferred only
- octanoyl-CoA is a substrate of CROTProteinHuman-GEM MAR00163Inferred only
- octanoyl-CoA is a substrate of CROTProteinRhea RHEA:17177Inferred only
- octanoyl-CoA is a substrate of CROTProteinHuman-GEM MAR03034Inferred only
- octanoyl-CoA is a substrate of EHHADHProteinHuman-GEM MAR06344Inferred only
- octanoyl-CoA is a substrate of GLYATL2ProteinRhea RHEA:64240Inferred only
- octanoyl-CoA is a substrate of HSD17B4ProteinHuman-GEM MAR06344Inferred only
- octanoyl-CoA is a substrate of LCLAT1ProteinRhea RHEA:38627Inferred only
- octanoyl-CoA is a substrate of LCLAT1ProteinRhea RHEA:38623Inferred only
- octanoyl-CoA is a substrate of LPCAT1ProteinRhea RHEA:37859Inferred only
- octanoyl-CoA is a substrate of LPCAT4ProteinRhea RHEA:37763Inferred only
- octanoyl-CoA is a substrate of LPCAT4ProteinRhea RHEA:37775Inferred only
- octanoyl-CoA is a substrate of MBOAT4ProteinRhea RHEA:59964Inferred only
- octanoyl-CoA is a substrate of MECRProteinHuman-GEM MAR02148Inferred only
- octanoyl-CoA is a substrate of MOGAT1ProteinRhea RHEA:77539Inferred only
- octanoyl-CoA is a substrate of MOGAT2ProteinRhea RHEA:77539Inferred only
- octanoyl-CoA is a substrate of NUDT19ProteinRhea RHEA:50016Inferred only
- octanoyl-CoA is a substrate of NUDT7ProteinRhea RHEA:50016Inferred only
- octanoyl-CoA is a substrate of NUDT8ProteinRhea RHEA:50016Inferred only
- octanoyl-CoA is a substrate of PHYHProteinRhea RHEA:54600Inferred only
- octanoyl-CoA is a substrate of THEM4ProteinRhea RHEA:30143Inferred only
Reactions
60 reactions
CHEBI:1146900+O-octanoyl-(R)-carnitine(S)-carnitine+octanoyl-CoA
Catalysed by CROT
Reaction pageReversibleBalancedEC 2.3.1.137mitochondrial matrix
Human-GEM MAR00163CC BY 4.0Reference data
ATP+CHEBI:1146900+octanoateAMP+octanoyl-CoA+diphosphate(3-)
Catalysed by ACSM3 or ACSM2B or ACSM1 or ACSM5 or ACSM2A or ACSM4
Reaction pageLeft to rightBalancedEC 6.2.1.2cytosol
Human-GEM MAR00174CC BY 4.0Reference data
Reaction pageReversibleBalancedcytosol, mitochondrial matrix
Human-GEM MAR00175CC BY 4.0Reference data
4CHEBI:1146900+4FAD+4water+4NAD(+)+palmitoyl-CoA4CHEBI:15351+4FADH2+4proton+4NADH(2-)+octanoyl-CoA
Reaction pageLeft to rightBalancedEC 4.2.1.74mitochondrial matrix
Human-GEM MAR00757CC BY 4.0Reference data
4CHEBI:1146900+4FAD+4water+4NAD(+)+palmitoyl-CoA4CHEBI:15351+4FADH2+4proton+4NADH(2-)+octanoyl-CoA
Catalysed by ACAA1 & HSD17B4 & ACOX1 or ACAA1 & EHHADH & ACOX1
Reaction pageLeft to rightBalancedEC 4.2.1.74peroxisome
Human-GEM MAR00759CC BY 4.0Reference data
(2E)-hexadecenoyl-CoA+4CHEBI:1146900+3FAD+4water+4NAD(+)4CHEBI:15351+3FADH2+4proton+4NADH(2-)+octanoyl-CoA
Reaction pageLeft to rightBalancedEC 4.2.1.74mitochondrial matrix
Human-GEM MAR00764CC BY 4.0Reference data
4CHEBI:1146900+3FAD+4water+4NAD(+)+(9Z)-hexadecenoyl-CoA4CHEBI:15351+3FADH2+4proton+4NADH(2-)+octanoyl-CoA
Reaction pageLeft to rightBalancedEC 4.2.1.74mitochondrial matrix
Human-GEM MAR00772CC BY 4.0Reference data
5CHEBI:1146900+4FAD+5water+5NAD(+)+(11Z)-octadecenoyl-CoA5CHEBI:15351+4FADH2+5proton+5NADH(2-)+octanoyl-CoA
Reaction pageLeft to rightBalancedEC 4.2.1.74mitochondrial matrix
Human-GEM MAR00780CC BY 4.0Reference data
5CHEBI:1146900+4FAD+5water+5NAD(+)+oleoyl-CoA5CHEBI:15351+4FADH2+5proton+5NADH(2-)+octanoyl-CoA
Reaction pageLeft to rightBalancedEC 4.2.1.74mitochondrial matrix
Human-GEM MAR00784CC BY 4.0Reference data
5CHEBI:1146900+3FAD+5water+(9Z,12Z)-octadecadienoyl-CoA+5NAD(+)5CHEBI:15351+3FADH2+5proton+5NADH(2-)+octanoyl-CoA
Reaction pageLeft to rightBalancedEC 4.2.1.74mitochondrial matrix
Human-GEM MAR00785CC BY 4.0Reference data
(9Z,12Z)-octadecadienoyl-CoA+5CHEBI:1146900+3FAD+5water+5NAD(+)5CHEBI:15351+3FADH2+5proton+5NADH(2-)+octanoyl-CoA
Reaction pageLeft to rightBalancedEC 4.2.1.74mitochondrial matrix
Human-GEM MAR00788CC BY 4.0Reference data
5CHEBI:1146900+(6Z,9Z,12Z)-octadecatrienoyl-CoA+5water+5NAD(+)+2dioxygen5CHEBI:15351+5proton+2hydrogen peroxide+5NADH(2-)+octanoyl-CoA
Reaction pageLeft to rightBalancedEC 4.2.1.74mitochondrial matrix
Human-GEM MAR00799CC BY 4.0Reference data
Other names
9 names
Resolves to: octanoyl-CoA
- Also called
- capryloyl-CoA tetraanioncapryloyl-CoA(4-)capryloyl-CoA(4−)capryloyl-coenzyme A(4-)capryloyl-coenzyme A(4−)octanoyl-CoA tetraanionoctanoyl-coenzyme A(4-)octanoyl-coenzyme A(4−)
- Systematic name
- 3'-phosphonatoadenosine 5'-(3-{(3R)-3-hydroxy-2,2-dimethyl-4-[(3-{[2-(octanoylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-4-oxobutyl} diphosphate)