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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:bufogenin
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Accession:CHEBI:31319 term browser browse the term
Definition:A steroid lactone of Chan su (toad venom), a Chinese medicine obtained from the skin venom gland of toads. A specific Na/K-ATPase protein inhibitor, it is used as a cardiotonic and central nervous system (CNS) respiratory agent, an analgesic and anesthetic, and as a remedy for ulcers.
Synonyms:exact_synonym: 3beta-hydroxy-5beta,15beta-14,15-epoxybufa-20,22-dienolide
 related_synonym: Bufogein;   Formula=C24H32O4;   InChI=1S/C24H32O4/c1-22-9-7-16(25)11-15(22)4-5-18-17(22)8-10-23(2)19(12-20-24(18,23)28-20)14-3-6-21(26)27-13-14/h3,6,13,15-20,25H,4-5,7-12H2,1-2H3/t15-,16+,17?,18?,19-,20-,22+,23-,24-/m1/s1;   InChIKey=ATLJNLYIJOCWJE-CWMZOUAVSA-N;   SMILES=[C@]12(CC[C@@H](C[C@]2(CC[C@]3([C@]45[C@](CC[C@]13[H])([C@H](C[C@H]4O5)C6=COC(C=C6)=O)C)[H])[H])O)C;   bufogenina;   bufogenine;   bufogeninum;   resibufogenin;   respigon
 xref: CAS:465-39-4;   Drug_Central:3523;   KEGG:C17058;   KEGG:D01378
 xref_mesh: MESH:C005734
 xref: PMID:22814872;   PMID:24911667;   PMID:25420080;   PMID:30029665;   PMID:31178234;   PMID:31292669;   PMID:31342712;   PMID:31737183;   PMID:31961485;   PMID:32006291


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bufogenin 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 increases expression
increases activity
increases metabolic processing
multiple interactions		 ISO bufogenin results in increased expression of CYP3A4 mRNA
bufogenin results in increased activity of CYP3A4 protein
CYP3A4 protein results in increased metabolism of bufogenin
bufogenin promotes the reaction [CYP3A4 protein results in increased metabolism of Midazolam]; Ketoconazole inhibits the reaction [CYP3A4 protein results in increased metabolism of bufogenin]		 CTD PMID:22178124 NCBI chr12:9,207,978...9,230,064
Ensembl chr12:9,015,383...9,285,008 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19880
    chemical entity 19878
      molecular entity 19878
        main group molecular entity 19817
          gas molecular entity 18472
            oxirane 11285
              epoxide 11284
                epoxy steroid 143
                  bufogenin 1
Path 2
Term Annotations click to browse term
  CHEBI ontology 19880
    subatomic particle 19878
      composite particle 19878
        hadron 19878
          baryon 19878
            nucleon 19878
              atomic nucleus 19878
                atom 19878
                  main group element atom 19817
                    p-block element atom 19817
                      carbon group element atom 19757
                        carbon atom 19754
                          organic molecular entity 19754
                            organic molecule 19706
                              organic cyclic compound 19495
                                organic heterocyclic compound 18874
                                  organic heteromonocyclic compound 17795
                                    saturated organic heteromonocyclic parent 11304
                                      oxirane 11285
                                        epoxide 11284
                                          epoxy steroid 143
                                            bufogenin 1
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