alpha-Methylbenzyl-butyrate

General

Type : Butyrate

Chemical_Nomenclature : 1-phenylethyl butanoate

Canonical SMILES : CCCC(=O)OC(C)C1=CC=CC=C1

InChI : InChI=1S\/C12H16O2\/c1-3-7-12(13)14-10(2)11-8-5-4-6-9-11\/h4-6,8-10H,3,7H2,1-2H3

InChIKey : GGKADXREVJTZMF-UHFFFAOYSA-N

Other name(s) : alpha-Methylbenzyl butyrate,     1-Phenylethyl butyrate,     1-Phenylethyl butanoate,     Butanoic acid, 1-phenylethyl ester


MW : 192.25

Formula : C12H16O2

CAS_number : 3460-44-4

PubChem :

UniChem :

Iuphar :

Target

Families : Canar_LipB

References (2)

Title : Modelling substrate specificity and enantioselectivity for lipases and esterases by substrate-imprinted docking - Juhl_2009_BMC.Struct.Biol_9_39
Author(s) : Juhl PB , Trodler P , Tyagi S , Pleiss J
Ref : BMC Struct Biol , 9 :39 , 2009
Abstract : Juhl_2009_BMC.Struct.Biol_9_39
ESTHER : Juhl_2009_BMC.Struct.Biol_9_39
PubMedSearch : Juhl_2009_BMC.Struct.Biol_9_39
PubMedID: 19493341

Title : Understanding the plasticity of the alpha\/beta hydrolase fold: lid swapping on the Candida antarctica lipase B results in chimeras with interesting biocatalytic properties - Skjot_2009_Chembiochem_10_520
Author(s) : Skjot M , De Maria L , Chatterjee R , Svendsen A , Patkar SA , Ostergaard PR , Brask J
Ref : Chembiochem , 10 :520 , 2009
Abstract : Skjot_2009_Chembiochem_10_520
ESTHER : Skjot_2009_Chembiochem_10_520
PubMedSearch : Skjot_2009_Chembiochem_10_520
PubMedID: 19156649
Gene_locus related to this paper: canar-LipB