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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: 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 20862
        role 20820
          biological role 20818
            aetiopathogenetic role 19855
              carcinogenic agent 18936
                methapyrilene 3544
                  methapyrilene hydrochloride 0
    Path 2
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      CHEBI ontology 20862
        subatomic particle 20860
          composite particle 20860
            hadron 20860
              baryon 20860
                nucleon 20860
                  atomic nucleus 20860
                    atom 20860
                      main group element atom 20781
                        main group molecular entity 20781
                          s-block molecular entity 20574
                            hydrogen molecular entity 20558
                              hydrides 19693
                                inorganic hydride 18602
                                  pnictogen hydride 18589
                                    nitrogen hydride 18502
                                      azane 18262
                                        ammonia 18261
                                          organic amino compound 18261
                                            polyamine 9126
                                              diamine 9061
                                                primary diamine 5736
                                                  alkane-alpha,omega-diamine 3807
                                                    ethylenediamine 3781
                                                      ethylenediamine derivative 3600
                                                        methapyrilene 3544
                                                          methapyrilene hydrochloride 0
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