Substrate Report for: 3,3-dimethylbutylacetateuncharged analog of acetylcholine
General Type | | Acetate | Chemical_Nomenclature | | 3,3-dimethylbutyl acetate | Canonical SMILES | | CC(=O)OCCC(C)(C)C | InChI | | InChI=1S/C8H16O2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3 | InChIKey | | AVXZMWDBEBBNOE-UHFFFAOYSA-N
| Other name(s) | | 1-Butanol, 3,3-dimethyl-, acetate ; 3,3-Dimethylbutylacetate ; 3,3-dimethylbutyl acetate ; DIMBA ; UNII-CR09Z7AWNB ; CR09Z7AWNB |
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Target Families | | | 3,3-dimethylbutylacetate ligand of proteins in family: ACHE |
References:
Title: Hydrolysis by acetylcholinesterase. Apparent molal volumes and trimethyl and methyl subsites
Hasan FB, Cohen SG, Cohen JB
Ref: Journal of Biological Chemistry, 255:3898, 1980 : PubMed
        
eleel-ACHE
WT Kinetics
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