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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:N-docosanoylsphingosine
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Accession:CHEBI:72966 term browser browse the term
Definition:A N-acylsphingosine in which the ceramide N-acyl group is specified as docosanoyl.
Synonyms:exact_synonym: N-[(2S,3R,4E)-1,3-dihydroxyoctadec-4-en-2-yl]docosanamide
 related_synonym: C22 Cer;   Cer(d18:1/22:0);   Ceramide (d18:1/22:0);   Formula=C40H79NO3;   InChI=1S/C40H79NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-40(44)41-38(37-42)39(43)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h33,35,38-39,42-43H,3-32,34,36-37H2,1-2H3,(H,41,44)/b35-33+/t38-,39+/m0/s1;   InChIKey=KEPQASGDXIEOIL-GLQCRSEXSA-N;   N-(docosanoyl)ceramide;   N-(docosanoyl)sphing-4-enine;   N-behenoylsphingosine;   N-docosanoylsphing-4-enine;   SMILES=CCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@H](O)\\C=C\\CCCCCCCCCCCCC
 xref: HMDB:HMDB0004952;   LIPID_MAPS_instance:LMSP02010008;   Reaxys:7317372


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Term Annotations click to browse term
  CHEBI ontology 19811
    role 19818
      biological role 19785
        biochemical role 19496
          metabolite 19484
            eukaryotic metabolite 19303
              plant metabolite 17945
                docosanoic acid 0
                  N-docosanoylsphingosine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19811
    subatomic particle 19809
      composite particle 19809
        hadron 19840
          baryon 19809
            nucleon 19809
              atomic nucleus 19809
                atom 19809
                  main group element atom 19759
                    main group molecular entity 19759
                      s-block molecular entity 19628
                        hydrogen molecular entity 19614
                          hydrides 19087
                            inorganic hydride 18091
                              pnictogen hydride 18080
                                nitrogen hydride 17987
                                  azane 17796
                                    ammonia 17795
                                      organic amino compound 17795
                                        amino alcohol 1072
                                          aminodiol 189
                                            2-aminooctadecene-1,3-diol 139
                                              2-aminooctadec-4-ene-1,3-diol 139
                                                sphing-4-enine 139
                                                  sphingosine 139
                                                    sphingosine-based sphingolipid 93
                                                      N-acylsphingosine 93
                                                        N-docosanoylsphingosine 0
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