CHEBI:15452 - (R)-3-hydroxybutanoyl-CoA

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ChEBI Name (R)-3-hydroxybutanoyl-CoA
ChEBI ID CHEBI:15452
ChEBI ASCII Name (R)-3-hydroxybutanoyl-CoA
Definition The (R)-enantiomer of 3-hydroxybutanoyl-CoA.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:10879, CHEBI:18667, CHEBI:10984, CHEBI:323
Supplier Information
Download Molfile XML SDF
Formula C25H42N7O18P3S
Net Charge 0
Average Mass 853.62464
Monoisotopic Mass 853.15199
InChI InChI=1S/C25H42N7O18P3S/c1-13(33)8-16(35)54-7-6-27-15(34)4-5-28-23(38)20(37)25(2,3)10-47-53(44,45)50-52(42,43)46-9-14-19(49-51(39,40)41)18(36)24(48-14)32-12-31-17-21(26)29-11-30-22(17)32/h11-14,18-20,24,33,36-37H,4-10H2,1-3H3,(H,27,34)(H,28,38)(H,42,43)(H,44,45)(H2,26,29,30)(H2,39,40,41)/t13-,14-,18-,19-,20+,24-/m1/s1
InChIKey QHHKKMYHDBRONY-WZZMXTMRSA-N
SMILES C[C@@H](O)CC(=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)n1cnc2c(N)ncnc12
Metabolite of Species Details
Mus musculus (NCBI:txidtxid10090) Source: BioModels - MODEL1507180067 See: PubMed
Roles Classification
Chemical Role(s): acyl donor
Any donor that can transfer acyl groups between molecular entities.
(via acyl-CoA )
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via 3-hydroxybutanoyl-CoA )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (R)-3-hydroxybutanoyl-CoA (CHEBI:15452) has functional parent (R)-3-hydroxybutyric acid (CHEBI:17066)
(R)-3-hydroxybutanoyl-CoA (CHEBI:15452) has role mouse metabolite (CHEBI:75771)
(R)-3-hydroxybutanoyl-CoA (CHEBI:15452) is a 3-hydroxybutanoyl-CoA (CHEBI:37050)
(R)-3-hydroxybutanoyl-CoA (CHEBI:15452) is conjugate acid of (R)-3-hydroxybutanoyl-CoA(4−) (CHEBI:57315)
Incoming (R)-3-hydroxybutanoyl-CoA(4−) (CHEBI:57315) is conjugate base of (R)-3-hydroxybutanoyl-CoA (CHEBI:15452)
IUPAC Name
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[(3R)-3-hydroxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
Synonyms Sources
(3R)-3-Hydroxybutanoyl-CoA KEGG COMPOUND
(R)-3-Hydroxybutanoyl-CoA KEGG COMPOUND
Manual Xref Database
C03561 KEGG COMPOUND
View more database links
Last Modified
27 January 2016