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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:Methylergonovine Maleate
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Accession:CHEBI:6874 term browser browse the term
Synonyms:related_synonym: Formula=C20H25N3O2;   Formula=C20H25N3O2.C4H4O4;   Formula=C24H29N3O6;   InChI=1S/C20H25N3O2.C4H4O4/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13;5-3(6)1-2-4(7)8/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25);1-2H,(H,5,6)(H,7,8)/b;2-1-/t13-,14+,18-;/m1./s1;   InChIKey=NOFOWWRHEPHDCY-DAUURJMHSA-N;   Methylergometrine maleate;   SMILES=C1=2C=3C=4[C@](N(C[C@@H](C4)C(N[C@@H](CC)CO)=O)C)(CC1=CNC2C=CC3)[H].C(/C=C\\C(O)=O)(O)=O
 xref: CAS:113-42-8;   CAS:57432-61-8;   KEGG:C07800;   KEGG:D00680
 xref_mesh: MESH:D008755
 xref: PMID:24134630


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Methylergonovine Maleate term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Htr2b 5-hydroxytryptamine receptor 2B multiple interactions ISO Methylergonovine binds to and results in increased activity of HTR2B protein CTD PMID:11104741 NCBI chr 9:86,735,793...86,756,638
Ensembl chr 9:86,742,102...86,755,108 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19921
    role 19893
      biological role 19891
        biochemical role 19598
          metabolite 19585
            alkaloid 8013
              ergoline alkaloid 21
                Methylergonovine Maleate 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19921
    subatomic particle 19919
      composite particle 19919
        hadron 19919
          baryon 19919
            nucleon 19919
              atomic nucleus 19919
                atom 19919
                  main group element atom 19865
                    main group molecular entity 19865
                      p-block molecular entity 19865
                        carbon group molecular entity 19804
                          organic molecular entity 19801
                            heteroorganic entity 19558
                              organonitrogen compound 18877
                                alkaloid 8013
                                  ergoline alkaloid 21
                                    Methylergonovine Maleate 1
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