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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:Temocaprilat
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Accession:CHEBI:9436 term browser browse the term
Definition:A non-proteinogenic alpha-amino acid that has formula C21H24N2O5S2.
Synonyms:related_synonym: Formula=C21H24N2O5S2;   InChI=1S/C21H24N2O5S2/c24-19(25)12-23-11-18(17-7-4-10-29-17)30-13-16(20(23)26)22-15(21(27)28)9-8-14-5-2-1-3-6-14/h1-7,10,15-16,18,22H,8-9,11-13H2,(H,24,25)(H,27,28)/t15-,16-,18-/m0/s1;   InChIKey=KZVWEOXAPZXAFB-BQFCYCMXSA-N;   RS 5139;   SMILES=OC(=O)CN1C[C@H](SC[C@H](N[C@@H](CCc2ccccc2)C(O)=O)C1=O)c1cccs1
 xref: CAS:110221-53-9;   HMDB:HMDB0061721;   KEGG:C11373
 xref_mesh: MESH:C069156


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Temocaprilat term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G ABCC2 ATP binding cassette subfamily C member 2 affects transport EXP ABCC2 protein affects the transport of temocaprilat CTD PMID:15507541 NCBI chr28:12,670,885...12,740,124
Ensembl chr28:12,670,885...12,740,740 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 495
    role 495
      application 453
        NMR chemical shift reference compound 327
          ammonia 322
            organic amino compound 322
              amino acid 39
                alpha-amino acid 21
                  non-proteinogenic alpha-amino acid 3
                    Temocaprilat 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 495
    subatomic particle 495
      composite particle 495
        hadron 495
          baryon 495
            nucleon 495
              atomic nucleus 495
                atom 495
                  main group element atom 488
                    main group molecular entity 488
                      s-block molecular entity 433
                        hydrogen molecular entity 432
                          hydrides 363
                            inorganic hydride 328
                              pnictogen hydride 327
                                nitrogen hydride 327
                                  azane 322
                                    ammonia 322
                                      organic amino compound 322
                                        amino acid 39
                                          non-proteinogenic amino acid 3
                                            non-proteinogenic alpha-amino acid 3
                                              Temocaprilat 1
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