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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:adefovir(1-)
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Accession:CHEBI:134512 term browser browse the term
Definition:A organophosphonate oxoanion obtained by removal of a proton from the phosphonate group of adefovir, a nucleoside reverse transcriptase inhibitor. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Synonyms:exact_synonym: hydrogen {[2-(6-amino-9H-purin-9-yl)ethoxy]methyl}phosphonate
 related_synonym: Formula=C8H11N5O4P;   InChI=1S/C8H12N5O4P/c9-7-6-8(11-3-10-7)13(4-12-6)1-2-17-5-18(14,15)16/h3-4H,1-2,5H2,(H2,9,10,11)(H2,14,15,16)/p-1;   InChIKey=SUPKOOSCJHTBAH-UHFFFAOYSA-M;   SMILES=C1=2C(N=CN1CCOCP(O)([O-])=O)=C(N=CN2)N;   adefovir
 xref: PMID:15914676
 cyclic_relationship: is_conjugate_base_of CHEBI:2469

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  CHEBI ontology 0
    chemical entity 0
      molecular entity 0
        ion 0
          organic ion 0
            organic anion 0
              organophosphonate oxoanion 0
                adefovir(1-) 0
Path 2
Term Annotations click to browse term
  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
                    main group molecular entity 0
                      p-block molecular entity 0
                        carbon group molecular entity 0
                          organic molecular entity 0
                            organic ion 0
                              organic anion 0
                                organophosphonate oxoanion 0
                                  adefovir(1-) 0
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