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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:(R)-lisofylline
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Accession:CHEBI:143527 term browser browse the term
Definition:A 1-(5-hydroxyhexyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione that has (R)-configuration. A synthetic small molecule which was under development for the treatment of type 1 diabetes mellitus.
Synonyms:exact_synonym: 1-[(5R)-5-hydroxyhexyl]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
 related_synonym: (R)-1-(5-hydroxyhexyl)-3,7-dimethylxanthine;   (R)-LSF;   1-(5R-hydroxyhexyl)-3,7-dimethylxanthine;   1-[(5R)-5-hydroxyhexyl]-3,7-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione;   1-[(R)-5-hydroxyhexyl]theobromine;   CT-1501R;   Formula=C13H20N4O3;   InChI=1S/C13H20N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8-9,18H,4-7H2,1-3H3/t9-/m1/s1;   InChIKey=NSMXQKNUPPXBRG-SECBINFHSA-N;   ProTec;   SMILES=C=12N(C=NC1N(C(N(C2=O)CCCC[C@H](O)C)=O)C)C;   lisofilina;   lisofylline;   lisofyllinum;   lisophylline
 xref: CAS:100324-81-0;   DrugBank:DB12406;   KEGG:D04748;   PMID:10330034;   PMID:11902249;   PMID:12242464;   PMID:12717280;   PMID:15588708;   PMID:25663650;   PMID:28730281;   PMID:30300750;   PMID:7735959;   Patent:WO2009099582;   Wikipedia:Lisofylline
 cyclic_relationship: is_enantiomer_of CHEBI:143564


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Term Annotations click to browse term
  CHEBI ontology 19831
    role 19807
      biological role 19805
        immunomodulator 15063
          (R)-lisofylline 0
            rac-lisofylline 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19831
    subatomic particle 19829
      composite particle 19829
        hadron 19829
          baryon 19829
            nucleon 19829
              atomic nucleus 19829
                atom 19829
                  main group element atom 19779
                    p-block element atom 19779
                      carbon group element atom 19728
                        carbon atom 19724
                          organic molecular entity 19724
                            organic molecule 19677
                              organic cyclic compound 19490
                                organic heterocyclic compound 18852
                                  organic heteropolycyclic compound 18295
                                    organic heterobicyclic compound 17240
                                      imidazopyrimidine 7717
                                        purines 7716
                                          aminopurine 6717
                                            2-aminopurines 6300
                                              guanine 6273
                                                xanthine 6196
                                                  methylxanthine 4087
                                                    dimethylxanthine 542
                                                      1-(5-hydroxyhexyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione 0
                                                        (R)-lisofylline 0
                                                          rac-lisofylline 0
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