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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:15-oxo-ETE-CoA
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Accession:CHEBI:137446 term browser browse the term
Definition:An oxo-fatty acyl-CoA that results from the formal condensation of the thiol group of coenzyme A with the carboxy group of 15-oxo-ETE.
Synonyms:exact_synonym: 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-2,2-dimethyl-4-({3-[(2-{[(5Z,8Z,11Z,13E)-15-oxoicosa-5,8,11,13-tetraenoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-4-oxobutyl] dihydrogen diphosphate}
 related_synonym: (5Z,8Z,11Z,13E)-15-oxoicosatetraenoyl-CoA;   15-keto-ETE-CoA;   Formula=C41H64N7O18P3S;   InChI=1S/C41H64N7O18P3S/c1-4-5-15-18-29(49)19-16-13-11-9-7-6-8-10-12-14-17-20-32(51)70-24-23-43-31(50)21-22-44-39(54)36(53)41(2,3)26-63-69(60,61)66-68(58,59)62-25-30-35(65-67(55,56)57)34(52)40(64-30)48-28-47-33-37(42)45-27-46-38(33)48/h6-7,10-13,16,19,27-28,30,34-36,40,52-53H,4-5,8-9,14-15,17-18,20-26H2,1-3H3,(H,43,50)(H,44,54)(H,58,59)(H,60,61)(H2,42,45,46)(H2,55,56,57)/b7-6-,12-10-,13-11-,19-16+/t30-,34-,35-,36+,40-/m1/s1;   InChIKey=FMJJHBYFPWVAAF-WUNWMFABSA-N;   SMILES=[C@@H]1(N2C3=C(C(=NC=N3)N)N=C2)O[C@H](COP(OP(OCC(C)([C@H](C(NCCC(NCCSC(CCC/C=C\\C/C=C\\C\\C=C/C=C/C(CCCCC)=O)=O)=O)=O)O)C)(=O)O)(=O)O)[C@H]([C@H]1O)OP(O)(O)=O
 xref: PMID:28238887
 cyclic_relationship: is_conjugate_acid_of CHEBI:136578

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Term Annotations click to browse term
  CHEBI ontology 19853
    role 19804
      biological role 19804
        biochemical role 19339
          metabolite 19319
            xenobiotic metabolite 14241
              human xenobiotic metabolite 13572
                15-oxo-ETE-CoA 0
Path 2
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  CHEBI ontology 19853
    subatomic particle 19851
      composite particle 19851
        hadron 19851
          baryon 19851
            nucleon 19851
              atomic nucleus 19851
                atom 19851
                  main group element atom 19744
                    p-block element atom 19744
                      chalcogen 19438
                        oxygen atom 19400
                          oxygen molecular entity 19400
                            hydroxides 19123
                              oxoacid 18256
                                pnictogen oxoacid 10291
                                  phosphorus oxoacid 9212
                                    phosphoric acids 7929
                                      phosphoric acid 7929
                                        phosphoric acid derivative 7611
                                          phosphate 7611
                                            organic phosphate 7610
                                              carbohydrate phosphate 1700
                                                phospho sugar 1627
                                                  aldose phosphate 1625
                                                    aldopentose phosphate 1619
                                                      ribose phosphate 1614
                                                        ribonucleotide 1575
                                                          purine ribonucleotide 1546
                                                            adenyl ribonucleotide 1250
                                                              adenosine phosphate 257
                                                                adenosine 5'-phosphate 256
                                                                  ADP 83
                                                                    coenzyme A 28
                                                                      acyl-CoA 28
                                                                        fatty acyl-CoA 16
                                                                          long-chain fatty acyl-CoA 10
                                                                            15-oxo-ETE-CoA 0
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