4-hydroxybutyryl-CoA

HCID 11966192

基本情報

標準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)CCCO
InChIKey: BAMBWCGEVIAQBF-CITAKDKDSA-N
分子式: C25H42N7O18P3S
平均分子量: 853.6 g/mol

概要

4-hydroxybutyryl-CoA is an acyl-CoA resulting from the formal condensation of the thiol group of coenzyme A with the carboxy group of 4-hydroxybutyric acid. It is functionally related to a 4-hydroxybutyric acid. It is a conjugate acid of a 4-hydroxybutyryl-CoA(4-).

名称と識別子

優先名称: 4-hydroxybutyryl-CoA
IUPAC: S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-hydroxybutanethioate

名称と別名

4-Hydroxybutyryl-CoA4-hydroxybutanoyl-CoA4-hydroxybutyryl-coenzyme ACHEBI:28522RefChem:99299coenzyme A, 4-hydroxybutyryl-3'-phosphoadenosine 5'-(3-((3R)-3-hydroxy-4-((3-((2-((4-hydroxybutanoyl)sulfanyl)ethyl)amino)-3-oxopropyl)amino)-2,2-dimethyl-4-oxobutyl)dihydrogen diphosphate);4-hydroxybutanoyl-coenzyme Agamma-hydroxybutyryl-CoAgamma-hydroxybutanoyl-CoA4-hydroxybutanoyl-coenzyme Agamma-hydroxybutyryl-coenzyme A3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(4-hydroxybutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl]dihydrogen diphosphate}

名称をさらに表示

S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-hydroxybutanethioateSCHEMBL59555BAMBWCGEVIAQBF-CITAKDKDSA-NQ27103753