2-Methylacetoacetyl-CoA (BioCAD00000002653)

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Metabolite Card

Formula: C26H42N7O18P3S (865.152)
SMILES: C[C@@H](C(C)=O)C(=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)N1C=NC2=C1N=CN=C2N

Synonyms [en]

2-Methylacetoacetyl-CoA; 2-methyl-3-acetoacetyl-CoA; 2-Methylacetoacetyl-coenzyme A; 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-{[3-({2-[(2-methyl-3-oxobutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-4-oxobutyl] dihydrogen diphosphate}; 2-methyl-3-acetoacetyl-coenzyme A; Coenzyme A, S-(2-methyl-3-oxobutanoate)

Reviewed

Last reviewed on 2024-06-28.

Cite this Page

2-Methylacetoacetyl-CoA. 数据之源，洞见之始. SMRUCC genomics institute, a synthetic life researcher from China. https://biocad_registry.innovation.ac.cn/s/(-)-arctiin (retrieved 2026-01-03) (CAD Registry RN: BioCAD00000002653). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Note

2-Methylacetoacetyl-CoA belongs to the class of organic compounds known as 3-oxo-acyl CoAs. These are organic compounds containing a 3-oxo acylated coenzyme A derivative. 2-Methylacetoacetyl-CoA is a substrate for 3-hydroxyacyl-CoA dehydrogenase type II, 3-ketoacyl-CoA thiolase (mitochondrial), peroxisomal bifunctional enzyme, trifunctional enzyme beta subunit (mitochondrial), short chain 3-hydroxyacyl-CoA dehydrogenase (mitochondrial), and 3-ketoacyl-CoA thiolase (peroxisomal).

Extracellular Membrane Mitochondria
Entity Information

DBLinks

Other DBLinks
  • CAS Registry Number: 6712-01-2
  • PubChem: 193425
  • ChEBI: ChEBI:15476
  • HMDB: HMDB0001157
  • HMDB: HMDB01157
  • LipidMaps: LMFA07050189
  • KEGG: C02154
  • KEGG: C03344
  • NCBI MeSH: 2-methylacetoacetyl-coenzyme A
  • Wikipedia: 2-Methylacetoacetyl-CoA
  • RefMet: RM0160053
  • Metlin: METLIN_458
  • Metlin: METLIN_63438
  • Coconut NaturalProduct: CNP0285899.1

Class / Ontology

Metabolic Network
ID EC Number Name
KEGG:R00927 2.3.1.9 acetyl-CoA:propanoyl-CoA 2-C-acetyltransferase;
KEGG:R04203 1.1.1.35 (2S,3S)-3-hydroxy-2-methylbutanoyl-CoA:NAD+ oxidoreductase
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Organism Source

Taxonomy Source

Pathway Synthetic

pathway id name
BioCyc:TRYPANO_ILEUDEG-PWY isoleucine degradation I
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