Compound
hexanedioyl-CoA
An acyl-CoA oxoanion that is the pentaanion of adipoyl-CoA, arising from deprotonation of the phosphate, diphosphate and carboxylic acid OH groups.
Definition from ChEBI (CHEBI:76327), read 2026-09-23. CC BY 4.0.
Structure
- Class
- Organic compound, anion
- Formula
- C27H39N7O19P3S
- Mass
- 890.628 g/mol
- Charge
- -5
- InChIKey
- SPNAEHGLBRRCGL-BIEWRJSYSA-I
- SMILES
- CC(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-])[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CCCCC(=O)[O-]
- Look it up
- ChEBIBy InChIKey
Identity from ChEBI. Not evidence.
What it touches on the way
Mechanistic reach
12 entities
12 entities reached.
0 reported hops12 assembled from the scaffold
- EHHADHProteinUNIPROT:Q08426substrate ofInferred only42 paths21 endpoints
- ACOT8ProteinUNIPROT:O14734substrate ofInferred only32 paths16 endpoints
- ACOX1ProteinUNIPROT:Q15067substrate ofInferred only30 paths15 endpoints
- CPT1AProteinUNIPROT:P50416substrate ofInferred only28 paths28 endpoints
- HSD17B4ProteinUNIPROT:P51659substrate ofInferred only27 paths27 endpoints
- ACAA1ProteinUNIPROT:P09110substrate ofInferred only24 paths24 endpoints
- SCP2ProteinUNIPROT:P22307substrate ofInferred only21 paths21 endpoints
- ECH1ProteinUNIPROT:Q13011substrate ofInferred only18 paths18 endpoints
- ACOX3ProteinUNIPROT:O15254substrate ofInferred only11 paths11 endpoints
- CPT1BProteinUNIPROT:Q92523substrate ofInferred only8 paths8 endpoints
- CROTProteinUNIPROT:Q9UKG9substrate ofInferred only7 paths7 endpoints
- CPT1CProteinUNIPROT:Q8TCG5substrate ofInferred only4 paths4 endpoints
What the reference databases state
Statements
17 statements
17 statements · 2 reference databases · Subject: hexanedioyl-CoA · Sources: Human-GEM, Rhea
- hexanedioyl-CoA is converted to adipic acidCompoundRhea RHEA:40583Inferred only
- hexanedioyl-CoA is a substrate of ACAA1ProteinHuman-GEM MAR06285Inferred only
- hexanedioyl-CoA is a substrate of ACOT8ProteinHuman-GEM MAR04447Inferred only
- hexanedioyl-CoA is a substrate of ACOT8ProteinRhea RHEA:40583Inferred only
- hexanedioyl-CoA is a substrate of ACOX1ProteinHuman-GEM MAR06285Inferred only
- hexanedioyl-CoA is a substrate of ACOX1ProteinHuman-GEM MAR11529Inferred only
- hexanedioyl-CoA is a substrate of ACOX3ProteinHuman-GEM MAR06285Inferred only
- hexanedioyl-CoA is a substrate of CPT1AProteinHuman-GEM MAR04745Inferred only
- hexanedioyl-CoA is a substrate of CPT1BProteinHuman-GEM MAR04745Inferred only
- hexanedioyl-CoA is a substrate of CPT1CProteinHuman-GEM MAR04745Inferred only
- hexanedioyl-CoA is a substrate of CROTProteinHuman-GEM MAR04445Inferred only
- hexanedioyl-CoA is a substrate of ECH1ProteinHuman-GEM MAR11529Inferred only
Show the remaining 5
- hexanedioyl-CoA is a substrate of EHHADHProteinHuman-GEM MAR11529Inferred only
- hexanedioyl-CoA is a substrate of EHHADHProteinHuman-GEM MAR06285Inferred only
- hexanedioyl-CoA is a substrate of HSD17B4ProteinHuman-GEM MAR06285Inferred only
- hexanedioyl-CoA is a substrate of SCP2ProteinHuman-GEM MAR06285Inferred only
- hexanedioyl-CoA is a substrate of SUGCTProteinRhea RHEA:81711Inferred only
Reactions
10 reactions
ATP+CHEBI:1146900+adipic acidAMP+diphosphate(3-)+hexanedioyl-CoA
Reaction pageLeft to rightBalancedcytosol
Human-GEM MAR04441CC BY 4.0Reference data
(S)-carnitine+hexanedioyl-CoACHEBI:1146900+MAM03499x
Catalysed by CROT
Reaction pageReversibleBalancedEC 2.3.1.137peroxisome
Human-GEM MAR04445CC BY 4.0Reference data
water+hexanedioyl-CoACHEBI:1146900+proton+adipic acid
Catalysed by ACOT8
Reaction pageLeft to rightBalancedEC 3.1.2.-peroxisome
Human-GEM MAR04447CC BY 4.0Reference data
(S)-carnitine+hexanedioyl-CoACHEBI:1146900+MAM03499c
Catalysed by CPT1A or CPT1C or CPT1B
Reaction pageReversibleBalancedEC 2.3.1.21cytosol
Human-GEM MAR04745CC BY 4.0Reference data
CHEBI:1146900+FAD+water+NAD(+)+hexanedioyl-CoACHEBI:15351+FADH2+proton+NADH(2-)+CHEBI:15380
Catalysed by ACAA1 & EHHADH & ACOX1 or SCP2 & EHHADH & ACOX1 or ACAA1 & HSD17B4 & ACOX1 or SCP2 & HSD17B4 & ACOX1 or ACOX3 & ACAA1 & EHHADH or ACOX3 & SCP2 & EHHADH or ACOX3 & ACAA1 & HSD17B4 or ACOX3 & SCP2 & HSD17B4
Reaction pageLeft to rightBalancedperoxisome
Human-GEM MAR06285CC BY 4.0Reference data
CHEBI:1146900+FAD+water+NAD(+)+octanedioyl-CoACHEBI:15351+FADH2+proton+NADH(2-)+hexanedioyl-CoA
Catalysed by ACAA1 & HSD17B4 & EHHADH & ACOX1
Reaction pageLeft to rightBalancedperoxisome
Human-GEM MAR06345CC BY 4.0Reference data
FAD+water+hexanedioyl-CoAFADH2+MAM03213x
Catalysed by EHHADH & ACOX1 or ECH1 & ACOX1
Reaction pageLeft to rightBalancedEC 1.3.3.6, 4.2.1.17peroxisome
Human-GEM MAR11529CC BY 4.0Reference data
CHEBI:76335+coenzyme A(4-)hexanedioyl-CoA+acetyl-CoA
Reaction pageDirection not assertedBalanced
Rhea RHEA:39067CC BY 4.0Reference data
hexanedioyl-CoA+wateradipic acid+coenzyme A(4-)+hydron
Catalysed by ACOT8
Reaction pageLeft to rightBalanced
Rhea RHEA:40583CC BY 4.0Reference data
adipic acid+glutaryl-CoAhexanedioyl-CoA+glutarate
Catalysed by SUGCT
Reaction pageReversibleBalanced
Rhea RHEA:81711CC BY 4.0Reference data
Other names
7 names
Resolves to: hexanedioyl-CoA
- Also called
- adipoyl-coenzyme A(5-)adipoyl-coenzyme A(5−)hexanedioyl-CoA(5-)hexanedioyl-CoA(5−)hexanedioyl-coenzyme A(5-)hexanedioyl-coenzyme A(5−)
- Systematic name
- 3'-phosphonatoadenosine 5'-{3-[(3R)-4-{[3-({2-[(3-carboxylatopentanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] diphosphate}