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Substrate Report for: IPG-caprylate

the production of enantiopure (S)-IPG, a chiral building block for the synthesis of beta-blockers, glycerophospholipids, and prostaglandins


General
Type IPG-ester, Octanoate
Chemical_Nomenclature (2,2-dimethyl-1,3-dioxolan-4-yl)methyl octanoate
Canonical SMILES CCCCCCCC(=O)OCC1COC(O1)(C)C
InChI InChI=1S/C14H26O4/c1-4-5-6-7-8-9-13(15)16-10-12-11-17-14(2,3)18-12/h12H,4-11H2,1-3H3
InChIKey GLKYAJSVVULZFA-UHFFFAOYSA-N GLKYAJSVVULZFA-GFCCVEGCSA-N
Other name(s) IPG caprylate ; IPG caprate ; IPG octanoate ; (2,2-dimethyl-1,3-dioxolan-4-yl)methyl Octanoate ; (2,2-dimethyl-1,3-dioxolan-4-yl)methyl Caprylate ; SCHEMBL6805094 ; 1-octanoyl-2,3-isopropylidene-glycerol ; Octanoic acid 2,2-dimethyl-1,3-dioxolane-4-ylmethyl ester ; (S)-(2,2-dimethyl-1,3-dioxolan-4-yl)methyl octanoate ; ZINC137298072 ; [(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl octanoate
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MW|258.35
Formula|C14H26O4
CAS_number|
PubChem|11230661, 121225616
UniChem|GLKYAJSVVULZFA-UHFFFAOYSA-N, GLKYAJSVVULZFA-GFCCVEGCSA-N
IUPHAR|
Wikipedia|


References:
Search PubMed for references concerning: IPG-caprylate

7 more
    Title: A stereospecific carboxyl esterase from Bacillus coagulans hosting nonlipase activity within a lipase-like fold
    De Vitis V, Nakhnoukh C, Pinto A, Contente ML, Barbiroli A, Milani M, Bolognesi M, Molinari F, Gourlay LJ, Romano D
    Ref: Febs J, 285:903, 2018 : PubMed

            

    Title: Newly isolated Streptomyces spp. as enantioselective biocatalysts: hydrolysis of 1,2-O-isopropylidene glycerol racemic esters
    Molinari F, Romano D, Gandolfi R, Kroppenstedt RM, Marinelli F
    Ref: J Appl Microbiol, 99:960, 2005 : PubMed

            

    Title: Paralogous gene analysis reveals a highly enantioselective 1,2-O-isopropylideneglycerol caprylate esterase of Bacillus subtilis
    Droge MJ, Bos R, Quax WJ
    Ref: European Journal of Biochemistry, 268:3332, 2001 : PubMed