1.02011-09-21 00:08:35 UTC2015-10-09 22:29:50 UTCFDB0221064-Phenylbutanoic acid4-phenylbutyrate (4-PBA) is known to be a transcriptional regulator, and sodium-4-PBA has been shown to induce fetal hemoglobin, and it has been used in clinical trials for sickle cell anemia and β-thalassemia Because gene expression profiles became more differentiated, it is in phase I trials in several different malignant disorders. The potential for therapeutic benefit in cystic fibrosis (CF) resides in an additional mechanism, involving protein folding and the ER environment. 4-PBA is a drug that was developed to treat elevated blood ammonia in urea cycle disorders, a histone deacetylase inhibitor that promotes mutation ΔF508 cystic fibrosis transmembrane conductance regulator (CFTR) trafficking. (PMID 12458151) [HMDB]4-PHENYL-butanoate4-PHENYL-butanoIC ACID4-Phenyl-butyrate4-Phenyl-butyric acid4-Phenyl-n-butyrate4-Phenyl-n-butyric acid4-Phenylbutanoate4-Phenylbutanoic acid4-Phenylbutyrate4-Phenylbutyric acidBenzenebutanoateBenzenebutanoic acidBenzenebutyrateBenzenebutyric acidg-Phenyl-butyrateg-Phenyl-butyric acidg-Phenyl-N-butyrateg-Phenyl-N-butyric acidg-Phenylbutanoateg-Phenylbutanoic acidg-Phenylbutyrateg-Phenylbutyric acidgamma-Phenyl-butyrategamma-Phenyl-butyric acidgamma-Phenyl-N-butyrategamma-Phenyl-N-butyric acidgamma-Phenylbutanoategamma-Phenylbutanoic acidgamma-Phenylbutyrategamma-Phenylbutyric acidomega-Phenylbutanoateomega-Phenylbutanoic acidOmega-phenylbutyrateOmega-phenylbutyric acidPBAw-Phenylbutanoatew-Phenylbutanoic acidγ-phenyl-N-butyrateγ-phenyl-N-butyric acidγ-phenylbutyrateγ-phenylbutyric acidC10H12O2164.2011164.0837296281821-12-1OC(=O)CCCC1=CC=CC=C1InChI=1S/C10H12O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)OBKXEAXTFZPCHS-UHFFFAOYSA-N belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.Benzene and substituted derivativesOrganic compoundsBenzenoidsBenzene and substituted derivativesAromatic homomonocyclic compoundsCarbonyl compoundsCarboxylic acidsHydrocarbon derivativesMonocarboxylic acids and derivativesOrganic oxidesAromatic homomonocyclic compoundCarbonyl groupCarboxylic acidCarboxylic acid derivativeHydrocarbon derivativeMonocarboxylic acid or derivativesMonocyclic benzene moietyOrganic oxideOrganic oxygen compoundOrganooxygen compoundmonocarboxylic acidSolidaverage_mass164.2011mono_mass164.083729628smilesOC(=O)CCCC1=CC=CC=C1formulaC10H12O2inchiInChI=1S/C10H12O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)inchikeyOBKXEAXTFZPCHS-UHFFFAOYSA-NSpecdb::NmrTwoD1356Specdb::MsIr620Specdb::MsIr621Specdb::MsIr622Specdb::NmrOneD1412Specdb::CMs9145Specdb::CMs29680Specdb::CMs37610Specdb::CMs99579Specdb::CMs165524Specdb::CMs1065598Specdb::MsMs761Specdb::MsMs762Specdb::MsMs763Specdb::MsMs264018Specdb::MsMs264019Specdb::MsMs264020Specdb::MsMs283947Specdb::MsMs283948Specdb::MsMs283949Specdb::MsMs2256306Specdb::MsMs2258290Specdb::MsMs2258341Specdb::MsMs2450809Specdb::MsMs2450810Specdb::MsMs2450811Specdb::MsMs2488686Specdb::MsMs2488687Specdb::MsMs2488688HMDB00543CLT#<Reference:0x00005556748ce400>#<Reference:0x00005556748ce0e0>#<Reference:0x00005556748cdf00>#<Reference:0x00005556748cdc58>AnatidaeType 1specificAnatidae8830BeefaloType 1specificBos taurus X Bison bison297284BisonType 1specificBison bison9901BuffaloType 1specificBubalus bubalis89462Cattle (Beef, Veal)Type 1specificBos taurus9913ChickenType 1specificGallus gallus9031Columbidae (Dove, Pigeon)Type 1specificColumbidae8930DeerType 1specificCervidae9850Domestic goatType 1specificCapra aegagrus hircus9925Domestic pigType 1specificSus scrofa domestica9825ElkType 1specificCervus canadensis1574408EmuType 1specificDromaius novaehollandiae8790European rabbitType 1specificOryctolagus9984Greylag gooseType 1specificAnser anser8843Guinea henType 1specificNumida meleagris8996HorseType 1specificEquus caballus9796Mallard duckType 1specificAnas platyrhynchos8839Mountain hareType 1specificLepus timidus62621Mule deerType 1specificOdocoileus9871OstrichType 1specificStruthio camelus8801PheasantType 1specificPhasianus colchicus9054QuailType 1specificPhasianidae9005RabbitType 1specificLeporidae9979Rock ptarmiganType 1specificLagopus muta64668Sheep (Mutton, Lamb)Type 1specificOvis aries9940SquabType 1specificColumba8931TurkeyType 1specificMeleagris gallopavo9103Velvet duckType 1specificMelanitta fusca371864Wild boarType 1specificSus scrofa9823