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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:dexamethasone phosphate
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Accession:CHEBI:68637 term browser browse the term
Definition:A steroid phosphate that is the 21-O-phospho derivative of dexamethasone.
Synonyms:exact_synonym: (11beta,16alpha)-9-fluoro-11,17-dihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-21-yl dihydrogen phosphate
 related_synonym: Betnelan phosphate;   Dexamethasone 21-orthophosphate;   Dexamethasone-21-dihydrogen-phosphate;   Formula=C22H30FO8P;   Hexadrol phosphate;   InChI=1S/C22H30FO8P/c1-12-8-16-15-5-4-13-9-14(24)6-7-19(13,2)21(15,23)17(25)10-20(16,3)22(12,27)18(26)11-31-32(28,29)30/h6-7,9,12,15-17,25,27H,4-5,8,10-11H2,1-3H3,(H2,28,29,30)/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1;   InChIKey=VQODGRNSFPNSQE-CXSFZGCWSA-N;   Neodecadron;   SMILES=[H][C@@]12C[C@@H](C)[C@](O)(C(=O)COP(O)(O)=O)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C
 xref: CAS:312-93-6;   Drug_Central:3920
 xref_mesh: MESH:C004180
 xref: PMID:19910302;   PMID:20003498;   PMID:20642832;   PMID:21629568;   PMID:22115712;   Reaxys:2230371
 cyclic_relationship: is_conjugate_acid_of CHEBI:68638


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  CHEBI ontology 0
    role 0
      biological role 0
        xenobiotic 0
          dexamethasone 0
            dexamethasone phosphate 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      chalcogen 0
                        oxygen atom 0
                          oxygen molecular entity 0
                            hydroxides 0
                              oxoacid 0
                                pnictogen oxoacid 0
                                  phosphorus oxoacid 0
                                    phosphoric acids 0
                                      phosphoric acid 0
                                        phosphoric acid derivative 0
                                          phosphate 0
                                            organic phosphate 0
                                              steroid phosphate 0
                                                dexamethasone phosphate 0
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