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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:methapyrilene
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Accession:CHEBI:6820 term browser browse the term
Definition:A member of the class of ethylenediamine derivatives that is ethylenediamine in which one of the nitrogens is substituted by two methyl groups, and the other nitrogen is substituted by a 2-pyridyl group and a (2-thienyl)methyl group.
Synonyms:exact_synonym: N,N-dimethyl-N'-pyridin-2-yl-N'-[(thiophen-2-yl)methyl]ethane-1,2-diamine
 related_synonym: 2-[[2-(dimethylamino)ethyl]-2-thenylamino]pyridine;   Formula=C14H19N3S;   Histadyl;   InChI=1S/C14H19N3S/c1-16(2)9-10-17(12-13-6-5-11-18-13)14-7-3-4-8-15-14/h3-8,11H,9-10,12H2,1-2H3;   InChIKey=HNJJXZKZRAWDPF-UHFFFAOYSA-N;   Lullamin;   N,N-dimethyl-N'-pyrid-2-yl-N'-2-thenylethylenediamine;   N,N-dimethyl-N'-pyridin-2-yl-N'-(2-thienylmethyl)ethane-1,2-diamine;   N-(alpha-pyridyl)-N-(alpha-thenyl)-N',N'-dimethylethylenediamine;   Paradormalene;   Pyrathyn;   Pyrinistab;   Pyrinistol;   Rest-on;   Restryl;   SMILES=CN(C)CCN(Cc1cccs1)c1ccccn1;   Semikon;   Sleepwell;   Thenylene;   Thionylan;   methypyrilene;   thenylpyramine
 xref: Beilstein:220729;   CAS:91-80-5;   DrugBank:DB04819;   Drug_Central:1738;   KEGG:C11114;   LINCS:LSM-5582
 xref_mesh: MESH:D008701
 xref: PMID:11137066;   PMID:22015589;   PMID:24486436;   Patent:US2581868;   Reaxys:220729;   Wikipedia:Methapyrilene


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  CHEBI ontology 19816
    role 19764
      biological role 19764
        aetiopathogenetic role 18960
          carcinogenic agent 18331
            methapyrilene 3504
              methapyrilene hydrochloride 0
Path 2
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  CHEBI ontology 19816
    subatomic particle 19814
      composite particle 19814
        hadron 19814
          baryon 19814
            nucleon 19814
              atomic nucleus 19814
                atom 19814
                  main group element atom 19702
                    main group molecular entity 19702
                      s-block molecular entity 19461
                        hydrogen molecular entity 19452
                          hydrides 18707
                            inorganic hydride 17430
                              pnictogen hydride 17402
                                nitrogen hydride 17243
                                  azane 16960
                                    ammonia 16959
                                      organic amino compound 16958
                                        polyamine 8136
                                          diamine 8063
                                            primary diamine 5628
                                              alkane-alpha,omega-diamine 3736
                                                ethylenediamine 3714
                                                  ethylenediamine derivative 3551
                                                    methapyrilene 3504
                                                      methapyrilene hydrochloride 0
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