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acetoacetyl-CoA - Ontology Report - Rat Genome Database

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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:acetoacetyl-CoA
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Accession:CHEBI:15345 term browser browse the term
Definition:A 3-oxoacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of acetoacetic acid.
Synonyms:exact_synonym: 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(3-oxobutanoyl)sulfanyl]ethyl}amino)propyl]amino}butyl] dihydrogen diphosphate}
 related_synonym: 3-Acetoacetyl-CoA;   Acetoacetyl coenzyme A;   Formula=C25H40N7O18P3S;   InChI=1S/C25H40N7O18P3S/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/h11-12,14,18-20,24,36-37H,4-10H2,1-3H3,(H,27,34)(H,28,38)(H,42,43)(H,44,45)(H2,26,29,30)(H2,39,40,41)/t14-,18-,19-,20+,24-/m1/s1;   InChIKey=OJFDKHTZOUZBOS-CITAKDKDSA-N;   S-Acetoacetyl-coenzym A;   S-acetoacetyl-CoA;   S-acetoacetyl-coenzyme A;   SMILES=CC(=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)N1C=NC2=C1N=CN=C2N
 alt_id: CHEBI:11756;   CHEBI:13706;   CHEBI:22173;   CHEBI:2392;   CHEBI:41333
 xref: CAS:1420-36-6;   DrugBank:DB03059;   FooDB:FDB022648;   HMDB:HMDB0001484;   KEGG:C00332;   KNApSAcK:C00007269;   LIPID_MAPS_instance:LMFA07050030
 xref_mesh: MESH:C010667
 xref: PDBeChem:CAA;   PMID:10806397;   PMID:11137815;   PMID:11451959;   PMID:12501183;   PMID:1682408;   PMID:16887802;   PMID:239468;   PMID:24211201;   PMID:26527136;   PMID:27093562;   PMID:27124816;   PMID:28062645;   PMID:29226071;   PMID:32218776;   PMID:6118268;   PMID:6150478;   PMID:7857927;   Reaxys:78273;   UM-BBD_compID:c0229;   Wikipedia:Acetoacetyl-CoA
 cyclic_relationship: is_conjugate_acid_of CHEBI:57286

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acetoacetyl-CoA term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G HSD17B2 hydroxysteroid 17-beta dehydrogenase 2 affects binding EXP acetoacetyl CoA binds to HSD17B2 protein CTD PMID:25526675 NCBI chr16:82,035,253...82,098,534
Ensembl chr16:82,035,004...82,098,534 		JBrowse link
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Term Annotations click to browse term
  CHEBI ontology 26827
    role 26655
      biological role 26634
        biochemical role 25889
          metabolite 25837
            acetoacetic acid 5
              acetoacetyl-CoA 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 26827
    subatomic particle 26803
      composite particle 26803
        hadron 26803
          baryon 26803
            nucleon 26803
              atomic nucleus 26803
                atom 26803
                  main group element atom 26554
                    p-block element atom 26554
                      chalcogen 25548
                        oxygen atom 25372
                          oxygen molecular entity 25372
                            hydroxides 24314
                              oxoacid 23217
                                pnictogen oxoacid 15898
                                  phosphorus oxoacid 15330
                                    phosphoric acids 14722
                                      phosphoric acid 14722
                                        phosphoric acid derivative 14633
                                          phosphate 14632
                                            organic phosphate 14632
                                              carbohydrate phosphate 2018
                                                phospho sugar 1858
                                                  aldose phosphate 1855
                                                    aldopentose phosphate 1847
                                                      ribose phosphate 1842
                                                        ribonucleotide 1800
                                                          purine ribonucleotide 1758
                                                            adenyl ribonucleotide 1352
                                                              adenosine phosphate 306
                                                                adenosine 5'-phosphate 305
                                                                  ADP 91
                                                                    3'-phosphate-adenosine-5'-diphosphate 30
                                                                      coenzyme A 30
                                                                        acyl-CoA 30
                                                                          fatty acyl-CoA 16
                                                                            short-chain fatty acyl-CoA 2
                                                                              butanoyl-CoAs 2
                                                                                butyryl-CoA 2
                                                                                  acetoacetyl-CoA 1
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