3,3-Dimethylbutyl-N-butylcarbamate

Inhibitor of ACHE but activator of BCHE

General

Type : Carbamate,Analogue of substrate

Chemical_Nomenclature : 3,3-dimethylbutyl N-butylcarbamate

Canonical SMILES : CCCCNC(=O)OCCC(C)(C)C

InChI : InChI=1S\/C11H23NO2\/c1-5-6-8-12-10(13)14-9-7-11(2,3)4\/h5-9H2,1-4H3,(H,12,13)

InChIKey : HMWVVNADQPDYDT-UHFFFAOYSA-N

Other name(s) : Butylcarbamic acid 3,3-dimethylbutyl ester,3,3-Dimethylbutyl-N-n-butylcarbamate


MW : 201.31

Formula : C11H23NO2

CAS_number :

PubChem : 102394631

UniChem : HMWVVNADQPDYDT-UHFFFAOYSA-N

Target

Families : 3,3-Dimethylbutyl-N-butylcarbamate ligand of proteins in family
BCHE ACHE

References (2)

Title : Activation mechanisms of butyrylcholinesterase by 2,4,6-trinitrotoluene, 3,3-dimethylbutyl-N-n-butylcarbamate, and 2-trimethylsilyl-ethyl-N-n-butylcarbamate - Chiou_2008_Appl.Biochem.Biotechnol_150_337
Author(s) : Chiou SY , Wu YG , Lin G
Ref : Appl Biochem Biotechnol , 150 :337 , 2008
Abstract : Chiou_2008_Appl.Biochem.Biotechnol_150_337
ESTHER : Chiou_2008_Appl.Biochem.Biotechnol_150_337
PubMedSearch : Chiou_2008_Appl.Biochem.Biotechnol_150_337
PubMedID: 18563305

Title : Substrate activation of butyrylcholinesterase and substrate inhibition of acetylcholinesterase by 3,3-dimethylbutyl-N-n-butylcarbamate and 2-trimethylsilyl-ethyl-N-n-butylcarbamate - Chiou_2007_J.Biochem.Mol.Toxicol_21_24
Author(s) : Chiou SY , Wu YG , Lin YF , Lin LY , Lin G
Ref : J Biochem Mol Toxicol , 21 :24 , 2007
Abstract : Chiou_2007_J.Biochem.Mol.Toxicol_21_24
ESTHER : Chiou_2007_J.Biochem.Mol.Toxicol_21_24
PubMedSearch : Chiou_2007_J.Biochem.Mol.Toxicol_21_24
PubMedID: 17366539
Array
(
    [id] => 792
    [inhibitor] => 3,3-Dimethylbutyl-N-butylcarbamate
    [type] => Array
        (
            [0] => Carbamate
            [1] => Analogue of substrate
        )

    [other_name] => Array
        (
            [0] => Butylcarbamic acid 3,3-dimethylbutyl ester
            [1] => 3,3-Dimethylbutyl-N-n-butylcarbamate
        )

    [chemical_nomenclature] => 3,3-dimethylbutyl N-butylcarbamate
    [formula] => C11H23NO2
    [cas_number] => 
    [mw] => 201.31
    [pick_me_to_call] => display_script
    [kinetic_parameter] => 
    [paper] => Chiou_2007_J.Biochem.Mol.Toxicol_21_24 || Chiou_2008_Appl.Biochem.Biotechnol_150_337
    [comment] => Inhibitor of ACHE but activator of BCHE
    [gene_locus] => 
    [kin_inhibitor] => 
    [cid] => 102394631
    [family] => BCHE || ACHE
    [inchikey] => HMWVVNADQPDYDT-UHFFFAOYSA-N
    [canonicalsmiles] => CCCCNC(=O)OCCC(C)(C)C
    [inchi] => InChI=1S\/C11H23NO2\/c1-5-6-8-12-10(13)14-9-7-11(2,3)4\/h5-9H2,1-4H3,(H,12,13)
    [wikipedia] => 
    [iupharlig] => 
    [structure] => 
    [substrate] => 
    [interact_gene_locus] => 
    [mutation] => 
    [comment2] => 
    [extoxnet] => 
    [news] => 
    [theoretical_model] => 
)