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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:miproxifene phosphate
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Accession:CHEBI:31855 term browser browse the term
Synonyms:related_synonym: Formula=C29H36NO5P;   InChI=1S/C29H36NO5P/c1-6-28(23-9-7-22(8-10-23)21(2)3)29(25-13-17-27(18-14-25)35-36(31,32)33)24-11-15-26(16-12-24)34-20-19-30(4)5/h7-18,21H,6,19-20H2,1-5H3,(H2,31,32,33)/b29-28+;   InChIKey=QZUHFMXJZOUZFI-ZQHSETAFSA-N;   SMILES=C1=C(C=CC(=C1)\\C(\\C=2C=CC(=CC2)OCCN(C)C)=C(\\C3=CC=C(C=C3)C(C)C)/CC)OP(O)(=O)O;   Tat 59
 xref: CAS:115767-74-3;   KEGG:D01853


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 22194
    role 22179
      application 21760
        NMR chemical shift reference compound 18740
          phosphoric acid 11726
            phosphoric acid derivative 11527
              organic phosphate 11526
                aryl phosphate 1246
                  miproxifene phosphate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22194
    subatomic particle 22186
      composite particle 22186
        hadron 22186
          baryon 22186
            nucleon 22186
              atomic nucleus 22186
                atom 22186
                  main group element atom 22120
                    p-block element atom 22120
                      chalcogen 21446
                        oxygen atom 21425
                          oxygen molecular entity 21425
                            hydroxides 20801
                              oxoacid 20115
                                pnictogen oxoacid 13702
                                  phosphorus oxoacid 12740
                                    phosphoric acids 11726
                                      phosphoric acid 11726
                                        phosphoric acid derivative 11527
                                          phosphate 11526
                                            organic phosphate 11526
                                              aryl phosphate 1246
                                                miproxifene phosphate 0
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