CHEBI:134246 - (R)-2-hydroxyglutaryl-CoA

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ChEBI Name (R)-2-hydroxyglutaryl-CoA
ChEBI ASCII Name (R)-2-hydroxyglutaryl-CoA
Definition A hydroxyglutaryl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of (R)-2-hydroxyglutaric acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C26H42N7O20P3S
Net Charge 0
Average Mass 897.635
Monoisotopic Mass 897.14182
InChI InChI=1S/C26H42N7O20P3S/c1-26(2,20(39)23(40)29-6-5-15(35)28-7-8-57-25(41)13(34)3-4-16(36)37)10-50-56(47,48)53-55(45,46)49-9-14-19(52-54(42,43)44)18(38)24(51-14)33-12-32-17-21(27)30-11-31-22(17)33/h11-14,18-20,24,34,38-39H,3-10H2,1-2H3,(H,28,35)(H,29,40)(H,36,37)(H,45,46)(H,47,48)(H2,27,30,31)(H2,42,43,44)/t13-,14-,18-,19-,20+,24-/m1/s1
SMILES [C@@H]1(N2C=3C(=C(N=CN3)N)N=C2)O[C@H](COP(OP(OCC([C@H](C(NCCC(NCCSC(=O)[C@@H](CCC(=O)O)O)=O)=O)O)(C)C)(=O)O)(=O)O)[C@H]([C@H]1O)OP(O)(O)=O
Roles Classification
Chemical Role(s): acyl donor
Any donor that can transfer acyl groups between molecular entities.
(via acyl-CoA )
Biological Role(s): bacterial xenobiotic metabolite
Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (R)-2-hydroxyglutaryl-CoA (CHEBI:134246) has role bacterial xenobiotic metabolite (CHEBI:76976)
(R)-2-hydroxyglutaryl-CoA (CHEBI:134246) is a 2-hydroxyglutaryl-CoA (CHEBI:28578)
(R)-2-hydroxyglutaryl-CoA (CHEBI:134246) is conjugate acid of (R)-2-hydroxyglutaryl-CoA(5−) (CHEBI:132946)
Incoming (R)-2-hydroxyglutaryl-CoA(5−) (CHEBI:132946) is conjugate base of (R)-2-hydroxyglutaryl-CoA (CHEBI:134246)
3'-phosphoadenosine 5'-{3-[(3R)-4-{[3-({2-{[(2R)-4-carboxy-2-hydroxybutanoyl]sulfanyl}ethyl}amino)-3-oxopropyl]amino}-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
Synonyms Sources
(R)-2-hydroxyglutaryl-coenzyme A ChEBI
2-Hydroxyglutaryl-1-coenzyme A ChemIDplus
Manual Xref Database
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Registry Numbers Types Sources
111769-66-5 CAS Registry Number ChemIDplus
21247358 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
11106419 PubMed citation Europe PMC
11243821 PubMed citation Europe PMC
11759672 PubMed citation Europe PMC
11980491 PubMed citation Europe PMC
12610725 PubMed citation Europe PMC
15450487 PubMed citation Europe PMC
18274792 PubMed citation Europe PMC
21037290 PubMed citation Europe PMC
21434666 PubMed citation Europe PMC
Last Modified
16 January 2017