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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:(R)-ethylmalonyl-CoA
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Accession:CHEBI:85803 term browser browse the term
Definition:An omega-carboxyacyl-CoA that results from the formal condensation of the thiol group of coenzyme A with one of the carboxy groups of (R)-ethylmalonic acid.
Synonyms:exact_synonym: 3'-phosphoadenosine 5'-{3-[(3R)-4-({3-[(2-{[(2R)-2-carboxybutanoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-3-hydroxy-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
 related_synonym: (2R)-ethylmalonyl-CoA;   (2R)-ethylmalonyl-coenzyme A;   (R)-ethylmalonyl-coenzyme A;   Formula=C26H42N7O19P3S;   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)/t13-,14-,17-,18-,19+,23-/m1/s1;   InChIKey=VUGZQVCBBBEZQE-XGVFZYDCSA-N;   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: Reaxys:22539666
 cyclic_relationship: is_conjugate_acid_of CHEBI:85316


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Term Annotations click to browse term
  CHEBI ontology 22178
    role 22194
      chemical role 21407
        donor 20266
          acyl donor 29
            acyl-CoA 29
              omega-carboxyacyl-CoA 2
                (R)-ethylmalonyl-CoA 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22178
    subatomic particle 22170
      composite particle 22170
        hadron 22201
          baryon 22170
            nucleon 22170
              atomic nucleus 22170
                atom 22170
                  main group element atom 22104
                    p-block element atom 22104
                      chalcogen 21431
                        oxygen atom 21437
                          oxygen molecular entity 21409
                            hydroxides 20789
                              oxoacid 20101
                                pnictogen oxoacid 13699
                                  phosphorus oxoacid 12721
                                    phosphoric acids 11722
                                      phosphoric acid 11710
                                        phosphoric acid derivative 11512
                                          phosphate 11511
                                            organic phosphate 11511
                                              carbohydrate phosphate 1855
                                                phospho sugar 1703
                                                  aldose phosphate 1701
                                                    aldopentose phosphate 1693
                                                      ribose phosphate 1685
                                                        ribonucleotide 1645
                                                          purine ribonucleotide 1612
                                                            adenyl ribonucleotide 1310
                                                              adenosine phosphate 299
                                                                adenosine 5'-phosphate 298
                                                                  ADP 88
                                                                    coenzyme A 29
                                                                      acyl-CoA 29
                                                                        omega-carboxyacyl-CoA 2
                                                                          (R)-ethylmalonyl-CoA 0
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