(2S,3S)-3-Hydroxy-2-methylbutanoyl-CoA (BioCAD00000000452)

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Metabolite Card

Formula: C26H44N7O18P3S (867.1676)
SMILES: C[C@H](O)[C@H](C)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]

(S)-3-hydroxy-2-methylbutyryl-CoA; (2S,3S)-3-Hydroxy-2-methylbutanoyl-CoA; 2-Methyl-3-hydroxybutyryl-CoA; (S,S)-3-Hydroxy-2-methylbutyryl-coenzyme A; 3-Hydroxy-2-methylbutyryl-coenzyme A; 2-methyl-3-hydroxybutyryl-Coenzyme A

Reviewed

Last reviewed on 2024-06-28.

Cite this Page

(2S,3S)-3-Hydroxy-2-methylbutanoyl-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: BioCAD00000000452). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Note

2-Methyl-3-hydroxybutyryl-CoA (CAS: 6701-38-8) belongs to the class of organic compounds known as (S)-3-hydroxyacyl-CoAs. These are organic compounds containing an (S)-3-hydroxyl acylated coenzyme A derivative. Thus, 2-methyl-3-hydroxybutyryl-CoA is considered to be a fatty ester lipid molecule. 2-Methyl-3-hydroxybutyryl-CoA is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. 2-Methyl-3-hydroxybutyryl-CoA is a substrate for 3-hydroxyacyl-CoA dehydrogenase type II, enoyl-CoA hydratase, trifunctional enzyme alpha subunit, short-chain 3-hydroxyacyl-CoA dehydrogenase, and peroxisomal bifunctional enzyme.

Extracellular Membrane Mitochondria
Entity Information

DBLinks

Other DBLinks
  • CAS Registry Number: 1169932-06-2
  • CAS Registry Number: 6701-38-8
  • PubChem: 11966220
  • PubChem: 440326
  • ChEBI: ChEBI:15449
  • ChEBI: ChEBI:165613
  • HMDB: HMDB0001356
  • KEGG: C04405
  • BioCyc: 2-METHYL-3-HYDROXY-BUTYRYL-COA
  • Wikipedia: 2-Methyl-3-hydroxybutyryl-CoA
  • RefMet: RM0153961
  • Metlin: METLIN_461
  • Coconut NaturalProduct: CNP0362004.1
  • Coconut NaturalProduct: CNP0362004.2

Class / Ontology

Metabolic Network
ID EC Number Name
KEGG:R04203 1.1.1.35 (2S,3S)-3-hydroxy-2-methylbutanoyl-CoA:NAD+ oxidoreductase
KEGG:R04204 4.2.1.17 (2S,3S)-3-hydroxy-2-methylbutanoyl-CoA hydro-liase
BioCyc:TIGLYLCOA-HYDROXY-RXN 4.2.1.150 tiglyl-CoA hydratase
BioCyc:1.1.1.178-RXN 1.1.1.178 NAD + 2-METHYL-3-HYDROXY-BUTYRYL-COA<=>PROTON + NADH + 2-METHYL-ACETO-ACETYL-COA
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Organism Source

Taxonomy Source

Pathway Synthetic

pathway id name
BioCyc:TRYPANO_ILEUDEG-PWY isoleucine degradation I
WikiPathways:WP3604 Biochemical pathways: part I
WikiPathways:WP662 Amino acid metabolism
WikiPathways:WP1451 Valine, leucine and isoleucine degradation
WikiPathways:WP3925 Amino acid metabolism
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