Compound
4,8,12-trimethyltridecanoyl-CoA
A multi-methyl-branched fatty acyl-CoA(4−) arising from deprotonation of phosphate and diphosphate functions of 4,8,12-trimethyltridecanoyl-CoA.
Definition from ChEBI (CHEBI:57351), read 2026-09-23. CC BY 4.0.
Structure
No three-dimensional record for this entry.
- Class
- Organic compound, anion
- Formula
- C37H62N7O17P3S
- Mass
- 1001.924 g/mol
- Charge
- -4
- InChIKey
- ZYUOZFCHODHLHG-LEJRVOBCSA-J
- SMILES
- CC(C)CCCC(C)CCCC(C)CCC(=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
5 entities
5 entities reached.
0 reported hops5 assembled from the scaffold
- HSD17B4ProteinUNIPROT:P51659substrate ofInferred only27 paths27 endpoints
- ACAA1ProteinUNIPROT:P09110substrate ofInferred only24 paths24 endpoints
- ACOX3ProteinUNIPROT:O15254substrate ofInferred only22 paths11 endpoints
- EHHADHProteinUNIPROT:Q08426substrate ofInferred only21 paths21 endpoints
- ACOX2ProteinUNIPROT:Q99424substrate ofInferred only17 paths17 endpoints
What the reference databases state
Statements
6 statements
6 statements · 1 reference database · Subject: 4,8,12-trimethyltridecanoyl-CoA · Sources: Human-GEM
- 4,8,12-trimethyltridecanoyl-CoA is a substrate of ACAA1ProteinHuman-GEM MAR05108Inferred only
- 4,8,12-trimethyltridecanoyl-CoA is a substrate of ACOX2ProteinHuman-GEM MAR03506Inferred only
- 4,8,12-trimethyltridecanoyl-CoA is a substrate of ACOX3ProteinHuman-GEM MAR05108Inferred only
- 4,8,12-trimethyltridecanoyl-CoA is a substrate of ACOX3ProteinHuman-GEM MAR03506Inferred only
- 4,8,12-trimethyltridecanoyl-CoA is a substrate of EHHADHProteinHuman-GEM MAR05108Inferred only
- 4,8,12-trimethyltridecanoyl-CoA is a substrate of HSD17B4ProteinHuman-GEM MAR05108Inferred only
Reactions
5 reactions
3-oxopristanoyl-CoA+CHEBI:11469004,8,12-trimethyltridecanoyl-CoA+propionyl-CoA
Reaction pageLeft to rightBalancedEC 2.3.1.176peroxisome
Human-GEM MAR03505CC BY 4.0Reference data
4,8,12-trimethyltridecanoyl-CoA+FADMAM00090x+FADH2
Reaction pageLeft to rightBalancedEC 1.3.3.6peroxisome
Human-GEM MAR03506CC BY 4.0Reference data
4,8,12-trimethyltridecanoyl-CoA+CHEBI:1146900+FAD+water+NAD(+)CHEBI:15351+FADH2+proton+NADH(2-)+MAM04004x
Catalysed by ACOX3 & ACAA1 & HSD17B4 & EHHADH
Reaction pageLeft to rightBalancedperoxisome
Human-GEM MAR05108CC BY 4.0Reference data
CHEBI:1146900+FAD+water+NAD(+)+pristanoyl-CoA4,8,12-trimethyltridecanoyl-CoA+FADH2+proton+NADH(2-)+propionyl-CoA
Catalysed by ACOX3 & ACAA1 & HSD17B4 & EHHADH
Reaction pageLeft to rightBalancedperoxisome
Human-GEM MAR05184CC BY 4.0Reference data
4,8,12-trimethyltridecanoyl-CoA+propanoyl-CoA3-oxopristanoyl-CoA+coenzyme A(4-)
Catalysed by SCP2
Reaction pageRight to leftBalanced
Rhea RHEA:10408CC BY 4.0Reference data
Other names
4 names
Resolves to: 4,8,12-trimethyltridecanoyl-CoA
- Also called
- 4,8,12-trimethyltridecanoyl-CoA tetraanion4,8,12-trimethyltridecanoyl-coenzyme A(4-)4,8,12-trimethyltridecanoyl-coenzyme A(4−)
- Systematic name
- 3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(4,8,12-trimethyltridecanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] diphosphate}