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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:12-(phosphonooxy)octadecanoic acid
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Accession:CHEBI:85133 term browser browse the term
Definition:A carboxyalkyl phosphate that is octadecanoic acid carrying a phosphonooxy substituent at position 12.
Synonyms:related_synonym: 12-(phosphonooxy)stearic acid;   Formula=C18H37O6P;   InChI=1S/C18H37O6P/c1-2-3-4-11-14-17(24-25(21,22)23)15-12-9-7-5-6-8-10-13-16-18(19)20/h17H,2-16H2,1H3,(H,19,20)(H2,21,22,23);   InChIKey=QZULXZYUVCCXJM-UHFFFAOYSA-N;   SMILES=CCCCCCC(CCCCCCCCCCC(O)=O)OP(O)(O)=O
 cyclic_relationship: is_conjugate_acid_of CHEBI:85134


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  CHEBI ontology 227
    role 227
      biological role 227
        biochemical role 188
          metabolite 181
            eukaryotic metabolite 159
              plant metabolite 71
                octadecanoic acid 1
                  12-(phosphonooxy)octadecanoic acid 0
Path 2
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  CHEBI ontology 227
    subatomic particle 227
      composite particle 227
        hadron 227
          baryon 227
            nucleon 227
              atomic nucleus 227
                atom 227
                  main group element atom 220
                    p-block element atom 220
                      carbon group element atom 208
                        carbon atom 207
                          organic molecular entity 207
                            organic group 154
                              organic divalent group 153
                                organodiyl group 153
                                  carbonyl group 153
                                    carbonyl compound 153
                                      carboxylic acid 114
                                        monocarboxylic acid 88
                                          fatty acid 56
                                            saturated fatty acid 51
                                              straight-chain saturated fatty acid 9
                                                octadecanoic acid 1
                                                  12-(phosphonooxy)octadecanoic acid 0
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