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Substrate Report for: Methyl(S)-3-hydroxybutyrate

General
Type Butyrate, Alkyl ester
Chemical_Nomenclature methyl (3S)-3-hydroxybutanoate
Canonical SMILES CC(CC(=O)OC)O
InChI InChI=1S/C5H10O3/c1-4(6)3-5(7)8-2/h4,6H,3H2,1-2H3/t4-/m0/s1 InChI=1S/C5H10O3/c1-4(6)3-5(7)8-2/h4,6H,3H2,1-2H3
InChIKey LDLDJEAVRNAEBW-BYPYZUCNSA-N LDLDJEAVRNAEBW-UHFFFAOYSA-N LDLDJEAVRNAEBW-SCSAIBSYSA-N
Other name(s) (+)-Methyl (S)-3-hydroxybutyrate ; Methyl (S)-(+)-3-hydroxybutyrate ; (S)-methyl 3-hydroxybutanoate ; Methyl (S)-3-hydroxybutyrate ; (S)-3-hydroxybutanoic acid methyl ester ; UNII-G10281A5AH ; Methyl 3-hydroxybutyrate ; Methyl 3-hydroxybutanoate ; Methyl-3-hydroxybutyrate ; Butanoic acid, 3-hydroxy-, methyl ester ; Butyric acid, 3-hydroxy-, methyl ester ; Methyl (R)-(-)-3-hydroxybutyrate ; (R)-Methyl 3-Hydroxybutanoate ; Methyl (3R)-3-hydroxybutanoate ; Methyl (R)-3-hydroxybutyrate ; UNII-CL06316S38
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MW|118.13
Formula|C5H10O3
CAS_number|53562-86-0, 1487-49-6, 3976-69-0
PubChem|6950307, 15146, 2724279
UniChem|LDLDJEAVRNAEBW-BYPYZUCNSA-N, LDLDJEAVRNAEBW-UHFFFAOYSA-N, LDLDJEAVRNAEBW-SCSAIBSYSA-N
IUPHAR|
Wikipedia|

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References:
Search PubMed for references concerning: Methyl(S)-3-hydroxybutyrate
    Title: Determinants and prediction of esterase substrate promiscuity patterns
    Martinez-Martinez M, Coscolin C, Santiago G, Chow J, Stogios PJ, Bargiela R, Gertler C, Navarro-Fernandez J, Bollinger A and Ferrer M <32 more author(s)>
    Ref: ACS Chemical Biology, 13:225, 2018 : PubMed

            

    Title: 3-Hydroxybutyrate methyl ester as a potential drug against Alzheimer's disease via mitochondria protection mechanism
    Zhang J, Cao Q, Li S, Lu X, Zhao Y, Guan JS, Chen JC, Wu Q, Chen GQ
    Ref: Biomaterials, 34:7552, 2013 : PubMed