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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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    Path 1
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      CHEBI ontology 20056
        role 20008
          biological role 20007
            aetiopathogenetic role 19275
              carcinogenic agent 18552
                methapyrilene 3511
                  methapyrilene hydrochloride 0
    Path 2
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      CHEBI ontology 20056
        subatomic particle 20054
          composite particle 20054
            hadron 20054
              baryon 20054
                nucleon 20054
                  atomic nucleus 20054
                    atom 20054
                      main group element atom 19956
                        main group molecular entity 19956
                          s-block molecular entity 19752
                            hydrogen molecular entity 19745
                              hydrides 19114
                                inorganic hydride 17882
                                  pnictogen hydride 17865
                                    nitrogen hydride 17754
                                      azane 17503
                                        ammonia 17502
                                          organic amino compound 17502
                                            polyamine 8321
                                              diamine 8250
                                                primary diamine 5688
                                                  alkane-alpha,omega-diamine 3766
                                                    ethylenediamine 3741
                                                      ethylenediamine derivative 3565
                                                        methapyrilene 3511
                                                          methapyrilene hydrochloride 0
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