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ONTOLOGY REPORT - ANNOTATIONS


Term:(S)-ethylmalonyl-CoA(5-)
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Accession:CHEBI:60909 term browser browse the term
Definition:An acyl-CoA oxoanion arising from deprotonation of the phosphate, diphosphate and carboxy groups of (2S)-ethylmalonyl-CoA.
Synonyms:exact_synonym: 3'-phosphonatoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2S)-2-carboxylatobutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] diphosphate}
 related_synonym: (2S)-2-ethylmalonyl-CoA(5-);   (2S)-ethylmalonyl coenzyme A(5-);   (2S)-ethylmalonyl-CoA;   (S)-2-ethylmalonyl-CoA(5-);   (S)-ethylmalonyl coenzyme A(5-);   Formula=C26H37N7O19P3S;   InChI=1S/C26H42N7O19P3S/c1-4-13(24(38)39)25(40)56-8-7-28-15(34)5-6-29-22(37)19(36)26(2,3)10-49-55(46,47)52-54(44,45)48-9-14-18(51-53(41,42)43)17(35)23(50-14)33-12-32-16-20(27)30-11-31-21(16)33/h11-14,17-19,23,35-36H,4-10H2,1-3H3,(H,28,34)(H,29,37)(H,38,39)(H,44,45)(H,46,47)(H2,27,30,31)(H2,41,42,43)/p-5/t13-,14+,17+,18+,19-,23+/m0/s1;   InChIKey=VUGZQVCBBBEZQE-UQCJFRAESA-I;   SMILES=CC[C@@H](C([O-])=O)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)n1cnc2c(N)ncnc12
 xref: PMID:17548827;   PMID:19458256
 cyclic_relationship: is_conjugate_base_of CHEBI:60907


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Term Annotations click to browse term
  CHEBI ontology 19778
    chemical entity 19777
      molecular entity 19775
        ion 15878
          anion 14850
            organic anion 3010
              carboxylic acid anion 2386
                (S)-ethylmalonyl-CoA(5-) 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19778
    subatomic particle 19776
      composite particle 19776
        hadron 19776
          baryon 19776
            nucleon 19776
              atomic nucleus 19776
                atom 19776
                  main group element atom 19662
                    p-block element atom 19662
                      chalcogen 19362
                        oxygen atom 19325
                          oxygen molecular entity 19325
                            hydroxides 19068
                              oxoacid 18163
                                pnictogen oxoacid 10117
                                  phosphorus oxoacid 9017
                                    phosphoric acids 7772
                                      phosphoric acid 7772
                                        phosphoric acid derivative 7452
                                          organophosphate oxoanion 1
                                            acyl-CoA oxoanion 0
                                              omega-carboxyacyl-CoA(5-) 0
                                                (S)-ethylmalonyl-CoA(5-) 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.