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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:alverine
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Accession:CHEBI:518413 term browser browse the term
Definition:A tertiary amine having one ethyl and two 3-phenylprop-1-yl groups attached to the nitrogen. An antispasmodic that acts directly on intestinal and uterine smooth muscle, it is used (particularly as the citrate salt) in the treatment of irritable bowel syndrome.
Synonyms:exact_synonym: N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine
 related_synonym: Bis(gamma-phenylpropyl)ethylamine;   Di(phenylpropyl)ethylamine;   Formula=C20H27N;   InChI=1S/C20H27N/c1-2-21(17-9-15-19-11-5-3-6-12-19)18-10-16-20-13-7-4-8-14-20/h3-8,11-14H,2,9-10,15-18H2,1H3;   InChIKey=ZPFXAOWNKLFJDN-UHFFFAOYSA-N;   N,N-Bis(3-phenylpropyl)ethylamine;   N-Ethyl-3,3'-diphenyldipropylamine;   N-Ethyl-3-phenyl-N-(3-phenylpropyl)-1-propanamine;   N-Ethyl-N-(3-phenylpropyl)benzenepropanamine;   Phenopropamine;   Phenpropamine;   SMILES=CCN(CCCc1ccccc1)CCCc1ccccc1;   alverina;   alverinum
 xref: Beilstein:2856783;   CAS:150-59-4;   DrugBank:DB01616;   Drug_Central:142;   KEGG:D07440;   LINCS:LSM-3988
 xref_mesh: MESH:C010846
 cyclic_relationship: is_conjugate_base_of CHEBI:64320


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alverine term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Htr1a 5-hydroxytryptamine receptor 1A affects binding EXP alverine binds to HTR1A protein CTD PMID:11697552 NCBI chr 2:36,246,628...36,247,896
Ensembl chr 2:36,246,628...36,247,896
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G Kcnh2 potassium voltage-gated channel subfamily H member 2 decreases activity ISO alverine results in decreased activity of KCNH2 protein CTD PMID:28551711 NCBI chr 4:7,355,066...7,387,282
Ensembl chr 4:7,355,574...7,387,253
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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19761
    role 19711
      application 19401
        refrigerant 17470
          ammonia 17006
            organic amino compound 17005
              amine 7799
                tertiary amine 614
                  alverine 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19761
    subatomic particle 19759
      composite particle 19759
        hadron 19759
          baryon 19759
            nucleon 19759
              atomic nucleus 19759
                atom 19759
                  main group element atom 19653
                    main group molecular entity 19653
                      s-block molecular entity 19418
                        hydrogen molecular entity 19411
                          hydrides 18751
                            inorganic hydride 17451
                              pnictogen hydride 17426
                                nitrogen hydride 17271
                                  azane 17007
                                    ammonia 17006
                                      organic amino compound 17005
                                        tertiary amino compound 8650
                                          tertiary amine 614
                                            alverine 2
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