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: benzethonium chloride
Accession: CHEBI:31264
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Definition: A (synthetic) quaternary ammonium salt that is benzyldimethylamine in which the nitrogen is quaternised by a 2-{2-[p-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy}ethyl group, with chloride as the counter-ion. An antiseptic and disinfectant, it is active against a broad spectrum of bacteria, fungi, moulds and viruses.
Synonyms: exact_synonym: N-benzyl-N,N-dimethyl-2-{2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy}ethanaminium chloride
related_synonym: Anti-germ 77; Antiseptol; BZT; Banagerm; Diapp; Disilyn; Formula=C27H42ClNO2; Hyamine; Hyamine 1622; InChI=1S/C27H42NO2.ClH/c1-26(2,3)22-27(4,5)24-13-15-25(16-14-24)30-20-19-29-18-17-28(6,7)21-23-11-9-8-10-12-23;/h8-16H,17-22H2,1-7H3;1H/q+1;/p-1; InChIKey=UREZNYTWGJKWBI-UHFFFAOYSA-M; Inactisol; Kylacol; Microklenz; N,N-dimethyl-N-(2-{2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy}ethyl)-benzenemethanaminium chloride; Neostelin green; Phemeride; Phemerol chloride; Phemithyn; Polymine D; QAC; Quatrachlor; SMILES=[Cl-].CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1; Salanine; Sanizol; Solamin; Solamine; benzethonii chloridum; benzetonium chloride; benzyldimethyl(2-{2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy}ethyl)ammonium chloride; benzyldimethyl(2-{2-[p-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy}ethyl)ammonium chloride; benzyldimethyl-p-(1,1,3,3-tetramethylbutyl)phenoxyethoxy-ethylammonium chloride; chlorure de benzethonium; cloruro de benzetonio; diisobutylphenoxyethoxyethyl dimethyl benzyl ammonium chloride; diisobutylphenoxyethoxyethyldimethyl benzyl ammonium chloride; p-diisobutyl phenoxyethoxyethyl dimethyl benzylammonium chloride; p-tert-octylphenoxyethoxyethyldimethylbenzylammonium chloride; {2-[2-(4-diisobutylphenoxy)ethoxy]ethyl}dimethylbenzylammonium chloride
xref: CAS:121-54-0; KEGG:C12539; KEGG:D01140
xref_mesh: MESH:D001558
xref: PMID:11453769; PMID:11606328; PMID:12595925; PMID:16750419; PMID:17867553; PMID:22828255; PMID:2310164; PMID:2735743; PMID:3416474; PMID:3995765; Patent:US2115250; Wikipedia:3898548; Wikipedia:Benzethonium_chloride
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Ccl2
C-C motif chemokine ligand 2
decreases expression
ISO
Benzethonium results in decreased expression of CCL2 protein
CTD
PMID:20116850
NCBI chr10:67,005,424...67,007,222
Ensembl chr10:67,005,424...67,007,226
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Ccl3
C-C motif chemokine ligand 3
decreases expression
ISO
Benzethonium results in decreased expression of CCL3 protein
CTD
PMID:20116850
NCBI chr10:68,451,388...68,452,938
Ensembl chr10:68,451,388...68,452,938
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Ccl4
C-C motif chemokine ligand 4
decreases expression
ISO
Benzethonium results in decreased expression of CCL4 protein
CTD
PMID:20116850
NCBI chr10:68,466,469...68,467,941
Ensembl chr10:68,452,052...68,468,231
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Ccl5
C-C motif chemokine ligand 5
decreases expression
ISO
Benzethonium results in decreased expression of CCL5 protein
CTD
PMID:20116850
NCBI chr10:68,322,826...68,327,365
Ensembl chr10:68,322,829...68,327,377
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Ifng
interferon gamma
multiple interactions
ISO
[Benzethonium co-treated with Ionomycin co-treated with Tetradecanoylphorbol Acetate] results in decreased expression of IFNG mRNA
CTD
PMID:29594315
NCBI chr 7:53,903,339...53,907,375
Ensembl chr 7:53,903,337...53,907,375
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Il1b
interleukin 1 beta
decreases expression
ISO
Benzethonium results in decreased expression of IL1B mRNA
CTD
PMID:29594315
NCBI chr 3:116,577,005...116,583,386
Ensembl chr 3:116,577,010...116,583,415
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Il2
interleukin 2
multiple interactions
ISO
[Benzethonium co-treated with Ionomycin co-treated with Tetradecanoylphorbol Acetate] results in decreased expression of IL2 mRNA
CTD
PMID:29594315
NCBI chr 2:120,004,862...120,009,566
Ensembl chr 2:120,004,862...120,009,566
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Il6r
interleukin 6 receptor
decreases expression
ISO
Benzethonium results in decreased expression of IL6R protein modified form
CTD
PMID:20116850
NCBI chr 2:175,289,157...175,347,719
Ensembl chr 2:175,298,686...175,347,536
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Kcna3
potassium voltage-gated channel subfamily A member 3
decreases activity multiple interactions
ISO
Benzethonium results in decreased activity of KCNA3 protein [Benzethonium results in decreased activity of KCNA3 protein] which results in decreased import of Thallium
CTD
PMID:21362439
NCBI chr 2:194,632,360...194,633,937
Ensembl chr 2:194,632,196...194,650,138
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Kcnh2
potassium voltage-gated channel subfamily H member 2
multiple interactions decreases activity
ISO
[Benzethonium results in decreased activity of KCNH2 protein] which results in decreased import of Thallium
CTD
PMID:21362439 PMID:23313619 PMID:24052561
NCBI chr 4:10,826,834...10,859,009
Ensembl chr 4:10,826,928...10,859,008
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Slc22a2
solute carrier family 22 member 2
multiple interactions
ISO
Benzethonium inhibits the reaction [SLC22A2 protein results in increased uptake of 4-(4-dimethylaminostyryl)-1-methylpyridinium]
CTD
PMID:21599003
NCBI chr 1:48,121,061...48,163,268
Ensembl chr 1:48,121,061...48,163,268
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Vegfa
vascular endothelial growth factor A
decreases expression
ISO
Benzethonium results in decreased expression of VEGFA protein
CTD
PMID:20116850
NCBI chr 9:14,955,300...14,970,641
Ensembl chr 9:14,955,300...14,970,641
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