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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:thioetheramide PC
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Accession:CHEBI:27712 term browser browse the term
Definition:A member of the class of 1-thio-sn-glycero-3-phosphocholines that is (2S)-2-amino-3-sulfanylpropyl 2-(trimethylazaniumyl)ethyl phosphate in which the amino group is substituted by a palmitoyl group and the thiol is substituted by a palmityl group. It is a reversible inhibitor of secretory phospholipase A2.
Synonyms:exact_synonym: (2S)-2-(hexadecanoylamino)-3-(hexadecylsulfanyl)propyl 2-(trimethylazaniumyl)ethyl phosphate
 related_synonym: (7S)-7-[(hexadecylsulfanyl)methyl]-4-hydroxy-N,N,N-trimethyl-4,9-dioxo-3,5-dioxa-8-aza-4lambda(5)-phosphatetracosan-1-aminium;   1,2-dideoxy-1-(S-hexadecyl)thio-2-(N-hexadecanoyl)amino-sn-glyceryl-3-phosphorylcholine;   1-hexadecylthio-2-hexadecanoylamino-1,2-dideoxy-sn-glycero-3-phosphocholine;   1-palmitylthio-2-palmitoylamido-1,2-dideoxy-sn-glycero-3-phosphorylcholine;   1-palmitylthio-2-palmitoylamino-1,2-dideoxy-sn-glycero-3-phosphorylcholine;   InChI=1S/C40H83N2O5PS/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-36-49-38-39(37-47-48(44,45)46-35-34-42(3,4)5)41-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h39H,6-38H2,1-5H3,(H-,41,43,44,45)/t39-/m0/s1;   InChIKey=WLWWVTPUDQTUJU-KDXMTYKHSA-N;   SMILES=C(CCCCCCCCCCCC)CCCSC[C@@H](NC(CCCCCCCCCCCCCCC)=O)COP(OCC[N+](C)(C)C)(=O)[O-]
 alt_id: CHEBI:19046;   CHEBI:629
 xref: CAS:116457-99-9;   KEGG:C04873;   PMID:14518563;   PMID:18264128;   PMID:20802406;   PMID:32484651


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19911
    role 19854
      biological role 19852
        osmolyte 3447
          glycerol 3188
            glycerolipid 1792
              glycerophospholipid 218
                glycerophosphocholine 124
                  1-thio-sn-glycero-3-phosphocholine 0
                    thioetheramide PC 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19911
    subatomic particle 19909
      composite particle 19909
        hadron 19880
          baryon 19880
            nucleon 19909
              atomic nucleus 19880
                atom 19909
                  main group element atom 19849
                    p-block element atom 19849
                      chalcogen 19598
                        oxygen atom 19570
                          oxygen molecular entity 19570
                            hydroxides 19374
                              oxoacid 18808
                                pnictogen oxoacid 14987
                                  phosphorus oxoacid 14587
                                    phosphoric acids 13935
                                      phosphoric acid 13935
                                        phosphoric acid derivative 13817
                                          phosphate 13843
                                            organic phosphate 13816
                                              phospholipid 322
                                                glycerophospholipid 218
                                                  glycerophosphocholine 124
                                                    1-thio-sn-glycero-3-phosphocholine 0
                                                      thioetheramide PC 0
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