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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:ajmaline
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Accession:CHEBI:28462 term browser browse the term
Definition:A monoterpenoid indole alkaloid that consists of ajmalan substituted at positions 17 and 21 by hydroxy groups.
Synonyms:exact_synonym: ajmalan-17alpha,21alpha-diol
 related_synonym: (5aR,6S,8S,10S,11S,11aS,12aR,13R)-5-methyl-5a,6,8,9,10,11,11a,12-octahydro-5H-6,10:11,12a-dimethanoindolo[3,2-b]quinolizine-8,13-diol;   Formula=C20H26N2O2;   InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10-,11-,14-,15-,16?,17-,18+,19+,20+/m0/s1;   InChIKey=CJDRUOGAGYHKKD-HEFSZTOGSA-N;   SMILES=[H][C@@]12C[C@H]3[C@H](CC)[C@@H](O)N1[C@H]1C[C@@]4([C@H](O)C31)c1ccccc1N(C)[C@@]24[H]
 alt_id: CHEBI:22275;   CHEBI:2525;   CHEBI:40717
 xref: CAS:4360-12-7;   DrugBank:DB01426;   KEGG:C06542;   KEGG:D00199;   KNApSAcK:C00001679;   KNApSAcK:C00024294
 xref_mesh: MESH:D000404
 cyclic_relationship: is_conjugate_base_of CHEBI:58567


show annotations for term's descendants           Sort by:
ajmaline term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Cyp3a2 cytochrome P450, family 3, subfamily a, polypeptide 2 multiple interactions ISO Ajmaline inhibits the reaction [Calcitriol results in increased expression of CYP3A4 protein] CTD PMID:29782822 NCBI chr12:9,207,978...9,230,064
Ensembl chr12:9,015,383...9,285,008 		JBrowse link
G Kcnh2 potassium voltage-gated channel subfamily H member 2 decreases activity ISO Ajmaline results in decreased activity of KCNH2 protein CTD PMID:15599706 PMID:24052561 NCBI chr 4:10,826,834...10,859,009
Ensembl chr 4:10,826,928...10,859,008 		JBrowse link
G Scn5a sodium voltage-gated channel alpha subunit 5 decreases activity
affects response to substance		 ISO Ajmaline results in decreased activity of SCN5A protein
SCN5A protein affects the susceptibility to Ajmaline		 CTD PMID:10662748 PMID:15520322 PMID:20174578 NCBI chr 8:119,220,905...119,318,816
Ensembl chr 8:119,220,905...119,318,769 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19890
    role 19839
      application 19703
        NMR chemical shift reference compound 18081
          ammonia 17860
            organic amino compound 17860
              hemiaminal 728
                ajmaline 3
                  17-O-acetylajmaline 0
                  norajmaline + 0
                  vinorine + 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19890
    subatomic particle 19867
      composite particle 19888
        hadron 19888
          baryon 19888
            nucleon 19867
              atomic nucleus 19888
                atom 19888
                  main group element atom 19806
                    main group molecular entity 19806
                      s-block molecular entity 19641
                        hydrogen molecular entity 19622
                          hydrides 19150
                            inorganic hydride 18152
                              pnictogen hydride 18164
                                nitrogen hydride 18055
                                  azane 17882
                                    ammonia 17860
                                      organic amino compound 17860
                                        hemiaminal 728
                                          ajmaline 3
                                            17-O-acetylajmaline 0
                                            norajmaline + 0
                                            vinorine + 0
paths to the root