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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:butyrylthiocholine
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Accession:CHEBI:41055 term browser browse the term
Definition:A quaternary ammonium ion obtained by the formal condensation of the carboxy group of butyric acid with the thiol group of thiocholine. It is used as a reagent for determination of butyrylcholinesterase activity.
Synonyms:exact_synonym: 2-(butanoylsulfanyl)-N,N,N-trimethylethan-1-aminium
 related_synonym: Formula=C9H20NOS;   InChI=1S/C9H20NOS/c1-5-6-9(11)12-8-7-10(2,3)4/h5-8H2,1-4H3/q+1;   InChIKey=AWBGQVBMGBZGLS-UHFFFAOYSA-N;   S-butanoylthiocholine;   S-butyrylthiocholine;   SMILES=CCCC(=O)SCC[N+](C)(C)C;   butanoylthiocholine
 xref: CAS:4555-00-4;   DrugBank:DB04250
 xref_mesh: MESH:D002092
 xref: PDBeChem:BCH;   PMID:25450746;   PMID:25486543;   Reaxys:1777055


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butyrylthiocholine term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Ache acetylcholinesterase increases hydrolysis
multiple interactions
ISO ACHE protein results in increased hydrolysis of Butyrylthiocholine
huperzine A inhibits the reaction [ACHE protein results in increased hydrolysis of Butyrylthiocholine]
CTD PMID:22407886 NCBI chr12:22,472,358...22,477,052
Ensembl chr12:22,472,358...22,478,753
JBrowse link
G Bche butyrylcholinesterase multiple interactions
increases hydrolysis
increases metabolic processing
ISO
EXP
[BCHE protein results in increased metabolism of Butyrylthiocholine] which results in increased chemical synthesis of Thiocholine; butyrylcholine inhibits the reaction [BCHE protein results in increased hydrolysis of Butyrylthiocholine]; Cholinesterase Inhibitors inhibits the reaction [BCHE protein results in increased hydrolysis of Butyrylthiocholine]; Dibucaine inhibits the reaction [BCHE protein results in increased metabolism of Butyrylthiocholine]; Echothiophate Iodide inhibits the reaction [BCHE protein results in increased hydrolysis of Butyrylthiocholine]; Isoflurophate inhibits the reaction [BCHE protein results in increased hydrolysis of Butyrylthiocholine]; N,N'-monomethylenebis(pyridiniumaldoxime) inhibits the reaction [Sarin analog inhibits the reaction [BCHE protein results in increased hydrolysis of Butyrylthiocholine]]; pralidoxime inhibits the reaction [Isoflurophate inhibits the reaction [BCHE protein results in increased hydrolysis of Butyrylthiocholine]]; pralidoxime inhibits the reaction [Sarin analog inhibits the reaction [BCHE protein results in increased hydrolysis of Butyrylthiocholine]]; profenamine inhibits the reaction [BCHE protein results in increased hydrolysis of Butyrylthiocholine]; Sarin analog inhibits the reaction [BCHE protein results in increased hydrolysis of Butyrylthiocholine]; Sodium Fluoride inhibits the reaction [BCHE protein results in increased metabolism of Butyrylthiocholine] CTD PMID:19699221 PMID:21802514 PMID:22407886 PMID:22922115 PMID:22940283 PMID:23123248 PMID:25054547 PMID:27109752 PMID:31247192 PMID:32278739 NCBI chr 2:171,104,476...171,196,186
Ensembl chr 2:171,100,140...171,196,395
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19773
    chemical entity 19773
      molecular entity 19772
        ion 15946
          organic ion 8466
            organic cation 7321
              quaternary ammonium ion 5111
                butyrylthiocholine 2
Path 2
Term Annotations click to browse term
  CHEBI ontology 19773
    subatomic particle 19772
      composite particle 19772
        hadron 19772
          baryon 19772
            nucleon 19772
              atomic nucleus 19772
                atom 19772
                  main group element atom 19662
                    main group molecular entity 19662
                      s-block molecular entity 19426
                        hydrogen molecular entity 19420
                          hydrides 18753
                            inorganic hydride 17457
                              pnictogen hydride 17433
                                nitrogen hydride 17280
                                  ammonium 8224
                                    ammonium ion derivative 8220
                                      quaternary ammonium ion 5111
                                        butyrylthiocholine 2
paths to the root