1.02011-09-21 00:10:30 UTC2015-10-09 22:30:50 UTCFDB022224Methylglutaric acidMethylglutaric acid is a leucine metabolite. A large amount of methylglutaric acid is identified in urine of patients with deficiency of 3-methylglutaconyl coenzyme A hydratase (PMID 6181239). [HMDB]3-methyl-Glutarate3-methyl-Glutaric acid3-Methylglutarate3-Methylglutaric acid3-Methylpentanedioate3-Methylpentanedioic acidb-methyl-Glutaric acidb-Methylglutarateb-Methylglutaric acidbeta-methyl-Glutaric acidbeta-Methylglutaratebeta-Methylglutaric acidMethylglutarateβ-methylglutarateβ-methylglutaric acidC6H10O4146.1412146.0579088083-methylpentanedioic acidmethylglutaric acid626-51-7CC(CC(O)=O)CC(O)=OInChI=1S/C6H10O4/c1-4(2-5(7)8)3-6(9)10/h4H,2-3H2,1H3,(H,7,8)(H,9,10)XJMMNTGIMDZPMU-UHFFFAOYSA-N belongs to the class of organic compounds known as methyl-branched fatty acids. These are fatty acids with an acyl chain that has a methyl branch. Usually, they are saturated and contain only one or more methyl group. However, branches other than methyl may be present.Methyl-branched fatty acidsOrganic compoundsLipids and lipid-like moleculesFatty AcylsFatty acids and conjugatesAliphatic acyclic compoundsCarbonyl compoundsCarboxylic acidsDicarboxylic acids and derivativesHydrocarbon derivativesOrganic oxidesAliphatic acyclic compoundCarbonyl groupCarboxylic acidCarboxylic acid derivativeDicarboxylic acid or derivativesHydrocarbon derivativeMethyl-branched fatty acidOrganic oxideOrganic oxygen compoundOrganooxygen compoundDicarboxylic acidsalpha,omega-dicarboxylic acidSolidlogp0.33logs-0.60solubility3.69e+01 g/llogp0.33pka_strongest_acidic3.91iupac3-methylpentanedioic acidaverage_mass146.1412mono_mass146.057908808smilesCC(CC(O)=O)CC(O)=OformulaC6H10O4inchiInChI=1S/C6H10O4/c1-4(2-5(7)8)3-6(9)10/h4H,2-3H2,1H3,(H,7,8)(H,9,10)inchikeyXJMMNTGIMDZPMU-UHFFFAOYSA-Npolar_surface_area74.6refractivity32.69polarizability13.88rotatable_bond_count4acceptor_count4donor_count2physiological_charge-2formal_charge0Specdb::EiMs700Specdb::MsIr826Specdb::MsIr827Specdb::MsIr828Specdb::NmrTwoD1467Specdb::NmrOneD1521Specdb::NmrOneD3246Specdb::NmrOneD20722Specdb::NmrOneD20723Specdb::NmrOneD20724Specdb::NmrOneD20725Specdb::NmrOneD20726Specdb::NmrOneD20727Specdb::NmrOneD20728Specdb::NmrOneD20729Specdb::NmrOneD20730Specdb::NmrOneD20731Specdb::NmrOneD20732Specdb::NmrOneD20733Specdb::NmrOneD20734Specdb::NmrOneD20735Specdb::NmrOneD20736Specdb::NmrOneD20737Specdb::NmrOneD20738Specdb::NmrOneD20739Specdb::NmrOneD20740Specdb::NmrOneD20741Specdb::CMs641Specdb::CMs1111Specdb::CMs18419Specdb::CMs30025Specdb::CMs30078Specdb::CMs30448Specdb::CMs31220Specdb::CMs32040Specdb::CMs37744Specdb::CMs151226Specdb::CMs1074716Specdb::CMs1074718Specdb::CMs1074719Specdb::MsMs1074Specdb::MsMs1075Specdb::MsMs1076Specdb::MsMs306844Specdb::MsMs306845Specdb::MsMs306846Specdb::MsMs350617Specdb::MsMs350618Specdb::MsMs350619Specdb::MsMs440128Specdb::MsMs451964Specdb::MsMs2236594Specdb::MsMs2236765Specdb::MsMs2238692Specdb::MsMs2238901Specdb::MsMs2240794Specdb::MsMs2240889Specdb::MsMs2242912Specdb::MsMs2242950Specdb::MsMs2831467Specdb::MsMs2831468Specdb::MsMs2831469Specdb::MsMs2847602Specdb::MsMs2847603Specdb::MsMs2847604HMDB00752#<Reference:0x000055567510bcf8>#<Reference:0x000055567510bb18>#<Reference:0x000055567510b8e8>#<Reference:0x000055567510b708>#<Reference:0x000055567510b4d8>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