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: benfuracarb
Accession: CHEBI:3014
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Definition: An ethyl ester that has formula C20H30N2O5S.
Synonyms: exact_synonym: ethyl 3-[{[{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]carbonyl}(methyl)amino]sulfanyl}(1-methylethyl)amino]propanoate
related_synonym: Aminofuracarb; Formula=C20H30N2O5S; InChI=1S/C20H30N2O5S/c1-7-25-17(23)11-12-22(14(2)3)28-21(6)19(24)26-16-10-8-9-15-13-20(4,5)27-18(15)16/h8-10,14H,7,11-13H2,1-6H3; InChIKey=FYZBOYWSHKHDMT-UHFFFAOYSA-N; N-(((((2,3-dihydro-2,2-dimethyl-7-benzofuranyl)oxy)carbonyl)methylamino)thio)-N-(1-methylethyl)-beta-alanine, ethyl ester; SMILES=CCOC(=O)CCN(SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12)C(C)C
xref: Beilstein:8347990; CAS:82560-54-1; KEGG:C11073
xref_mesh: MESH:C096128
xref: PPDB:63
G
ACHE
acetylcholinesterase (Yt blood group)
decreases activity
EXP
benfuracarb metabolite results in decreased activity of ACHE protein; benfuracarb results in decreased activity of ACHE protein
CTD
PMID:33844597
NCBI chr 7:100,889,994...100,896,994
Ensembl chr 7:100,889,994...100,896,974
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CYP2B6
cytochrome P450 family 2 subfamily B member 6
increases expression increases activity
EXP
benfuracarb results in increased expression of CYP2B6 mRNA benfuracarb results in increased activity of CYP2B6 protein
CTD
PMID:22310298
NCBI chr19:40,991,282...41,018,398
Ensembl chr19:40,991,282...41,018,398
G
CYP2C19
cytochrome P450 family 2 subfamily C member 19
increases oxidation
EXP
CYP2C19 protein results in increased oxidation of benfuracarb
CTD
PMID:24016712
NCBI chr10:94,762,681...94,855,547
Ensembl chr10:94,762,681...94,855,547
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CYP2C9
cytochrome P450 family 2 subfamily C member 9
increases oxidation
EXP
CYP2C9 protein results in increased oxidation of benfuracarb
CTD
PMID:24016712
NCBI chr10:94,938,658...94,990,091
Ensembl chr10:94,938,658...94,990,091
G
CYP3A4
cytochrome P450 family 3 subfamily A member 4
increases expression increases activity increases metabolic processing multiple interactions
EXP
benfuracarb results in increased expression of CYP3A4 mRNA benfuracarb results in increased activity of CYP3A4 protein CYP3A4 protein results in increased metabolism of benfuracarb [CYP3A4 protein results in increased metabolism of benfuracarb] which results in increased chemical synthesis of Carbofuran
CTD
PMID:22310298 PMID:24016712
NCBI chr 7:99,756,967...99,784,184
Ensembl chr 7:99,756,960...99,784,248
G
NR1I3
nuclear receptor subfamily 1 group I member 3
increases expression increases activity
ISO EXP
benfuracarb results in increased expression of NR1I3 mRNA benfuracarb results in increased activity of NR1I3 protein
CTD
PMID:22310298 PMID:28927721
NCBI chr 1:161,229,669...161,238,203
Ensembl chr 1:161,229,666...161,238,244
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