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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:valganciclovir
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Accession:CHEBI:63635 term browser browse the term
Definition:The L-valinyl ester of ganciclovir, into which it is rapidly converted by intestinal and hepatic esterases. It is a synthetic analogue of 2'-deoxyguanosine.
Synonyms:related_synonym: 2-[(2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)methoxy]-3-hydroxypropyl L-valinate
 xref: CAS:175865-60-8;   DrugBank:DB01610
 xref_mesh: MESH:D000077562
 xref: Reaxys:14503833;   drugcentral:2801;   kegg.drug:D02495;   wikipedia.en:Valganciclovir
 chemrof_formula: C14H22N6O5
 chemrof_smiles: CC(C)[C@H](N)C(=O)OCC(CO)OCn1cnc2c(=O)nc(N)nc21
 chemrof_inchi: InChI=1S/C14H22N6O5/c1-7(2)9(15)13(23)24-4-8(3-21)25-6-20-5-17-10-11(20)18-14(16)19-12(10)22/h5,7-9,21H,3-4,6,15H2,1-2H3,(H3,16,18,19,22)/t8?,9-/m0/s1
 chemrof_inchikey: WPVFJKSGQUFQAP-GKAPJAKFSA-N
 cyclic_relationship: has_functional_parent CHEBI:16235;   has_functional_parent CHEBI:465284


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valganciclovir term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Bphl biphenyl hydrolase like increases hydrolysis ISO BPHL protein results in increased hydrolysis of Valganciclovir CTD PMID:15832508 NCBI chr17:31,006,283...31,042,631
Ensembl chr17:31,004,972...31,042,632 		JBrowse link
G Slc15a1 solute carrier family 15 member 1 increases transport
multiple interactions 		ISO SLC15A1 protein results in increased transport of Valganciclovir
Valganciclovir inhibits the reaction [SLC15A1 protein results in increased transport of glycylsarcosine] 		CTD PMID:10824137 NCBI chr15:104,944,461...104,991,316
Ensembl chr15:104,944,463...104,989,369 		JBrowse link
G Slc15a2 solute carrier family 15 member 2 multiple interactions EXP Valganciclovir inhibits the reaction [SLC15A2 protein results in increased transport of glycylsarcosine] CTD PMID:10824137 NCBI chr11:77,519,565...77,548,609
Ensembl chr11:77,519,529...77,548,606 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 20874
    role 20844
      application 20572
        pro-agent 8265
          prodrug 7985
            valganciclovir 3
Path 2
Term Annotations click to browse term
  CHEBI ontology 20874
    subatomic particle 20883
      composite particle 20883
        hadron 20872
          baryon 20883
            nucleon 20872
              atomic nucleus 20883
                atom 20872
                  main group element atom 20796
                    p-block element atom 20796
                      carbon group element atom 20712
                        carbon atom 20706
                          organic molecular entity 20706
                            heteroorganic entity 20201
                              organochalcogen compound 19822
                                organooxygen compound 19713
                                  ester 17841
                                    carboxylic ester 17347
                                      amino-acid ester 321
                                        alpha-amino acid ester 156
                                          L-valyl ester 3
                                            valganciclovir 3
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