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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:18-oxoresolvin E1(1-)
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Accession:CHEBI:91001 term browser browse the term
Definition:An icosanoid anion resulting from the removal of a proton from the carboxy group of 18-oxoresolvin E1; major species at pH 7.3.
Synonyms:exact_synonym: (5S,6Z,8E,10E,12R,14Z,16E)-5,12-dihydroxy-18-oxoicosa-6,8,10,14,16-pentaenoate
 related_synonym: 18-oxo-5S,12R-dihydroxy-6Z,8E,10E,14Z,16E-eicosapentaenoate;   18-oxo-RvE1(1-);   18-oxo-resolvin E1;   18-oxo-resolvin E1(1-);   Formula=C20H27O5;   InChI=1S/C20H28O5/c1-2-17(21)11-8-5-9-14-18(22)12-6-3-4-7-13-19(23)15-10-16-20(24)25/h3-9,11-13,18-19,22-23H,2,10,14-16H2,1H3,(H,24,25)/p-1/b4-3+,9-5-,11-8+,12-6+,13-7-/t18-,19+/m0/s1;   InChIKey=CMOJNYRANQREGD-IJDHQMKWSA-M;   SMILES=C(\\[C@H](CCCC([O-])=O)O)=C\\C=C\\C=C\\[C@@H](C\\C=C/C=C/C(CC)=O)O
 xref: PMID:16757471
 cyclic_relationship: is_conjugate_base_of CHEBI:131617


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  CHEBI ontology 397
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  CHEBI ontology 397
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                                  monocarboxylic acid anion 3
                                    fatty acid anion 0
                                      unsaturated fatty acid anion 0
                                        polyunsaturated fatty acid anion 0
                                          18-oxoresolvin E1(1-) 0
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