1.0 2011-09-21 00:06:11 UTC 2015-07-21 06:56:54 UTC FDB021968 3-Hydroxyadipic acid 3-Hydroxyadipic acid is a normal urinary dicarboxylic acid derived from the omega-oxidation of 3-hydroxy fatty acids and the subsequent beta-oxidation of longer chain 3-hydroxy dicarboxylic acids (PMID 2001377). It is found to be elevated in patients with 3-hydroxydicarboxylic aciduria (PMID 1444166) and non-ketotic hypoglycemia (PMID 3168281). [HMDB] (3S)-3-hydroxyadipate (3S)-3-hydroxyadipic acid 3-Hydroxyadipate 3-Hydroxyadipic acid 3-Hydroxyhexanedioate 3-Hydroxyhexanedioic acid C6H10O5 162.1406 162.05282343 3-hydroxyhexanedioic acid 3-hydroxyadipic acid 14292-29-6 OC(CCC(O)=O)CC(O)=O InChI=1S/C6H10O5/c7-4(3-6(10)11)1-2-5(8)9/h4,7H,1-3H2,(H,8,9)(H,10,11) YVOMYDHIQVMMTA-UHFFFAOYSA-N belongs to the class of organic compounds known as medium-chain hydroxy acids and derivatives. These are hydroxy acids with a 6 to 12 carbon atoms long side chain. Medium-chain hydroxy acids and derivatives Organic compounds Organic acids and derivatives Hydroxy acids and derivatives Medium-chain hydroxy acids and derivatives Aliphatic acyclic compounds Beta hydroxy acids and derivatives Carbonyl compounds Carboxylic acids Dicarboxylic acids and derivatives Hydrocarbon derivatives Hydroxy fatty acids Medium-chain fatty acids Organic oxides Secondary alcohols Alcohol Aliphatic acyclic compound Beta-hydroxy acid Carbonyl group Carboxylic acid Carboxylic acid derivative Dicarboxylic acid or derivatives Fatty acid Fatty acyl Hydrocarbon derivative Hydroxy fatty acid Medium-chain fatty acid Medium-chain hydroxy acid Organic oxide Organic oxygen compound Organooxygen compound Secondary alcohol Dicarboxylic acids Solid logp -0.89 ALOGPS logs -0.26 ALOGPS solubility 8.82e+01 g/l ALOGPS logp -0.74 ChemAxon pka_strongest_acidic 3.7 ChemAxon pka_strongest_basic -2.8 ChemAxon iupac 3-hydroxyhexanedioic acid ChemAxon average_mass 162.1406 ChemAxon mono_mass 162.05282343 ChemAxon smiles OC(CCC(O)=O)CC(O)=O ChemAxon formula C6H10O5 ChemAxon inchi InChI=1S/C6H10O5/c7-4(3-6(10)11)1-2-5(8)9/h4,7H,1-3H2,(H,8,9)(H,10,11) ChemAxon inchikey YVOMYDHIQVMMTA-UHFFFAOYSA-N ChemAxon polar_surface_area 94.83 ChemAxon refractivity 34.25 ChemAxon polarizability 14.78 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 433 Specdb::MsIr 434 Specdb::MsIr 435 Specdb::NmrOneD 20282 Specdb::NmrOneD 20283 Specdb::NmrOneD 20284 Specdb::NmrOneD 20285 Specdb::NmrOneD 20286 Specdb::NmrOneD 20287 Specdb::NmrOneD 20288 Specdb::NmrOneD 20289 Specdb::NmrOneD 20290 Specdb::NmrOneD 20291 Specdb::NmrOneD 20292 Specdb::NmrOneD 20293 Specdb::NmrOneD 20294 Specdb::NmrOneD 20295 Specdb::NmrOneD 20296 Specdb::NmrOneD 20297 Specdb::NmrOneD 20298 Specdb::NmrOneD 20299 Specdb::NmrOneD 20300 Specdb::NmrOneD 20301 Specdb::CMs 10998 Specdb::CMs 37449 Specdb::CMs 167391 Specdb::CMs 1059076 Specdb::CMs 1059078 Specdb::CMs 1059080 Specdb::CMs 1059082 Specdb::CMs 1059083 Specdb::CMs 1059085 Specdb::CMs 1059087 Specdb::CMs 1059089 Specdb::CMs 1059091 Specdb::CMs 1059093 Specdb::CMs 1059094 Specdb::CMs 1059096 Specdb::CMs 1059098 Specdb::MsMs 555 Specdb::MsMs 556 Specdb::MsMs 557 Specdb::MsMs 290245 Specdb::MsMs 290246 Specdb::MsMs 290247 Specdb::MsMs 329878 Specdb::MsMs 329879 Specdb::MsMs 329880 Specdb::MsMs 2805165 Specdb::MsMs 2805166 Specdb::MsMs 2805167 Specdb::MsMs 2876633 Specdb::MsMs 2876634 Specdb::MsMs 2876635 HMDB00345 #<Reference:0x000055ce31666a70> #<Reference:0x000055ce31666818> #<Reference:0x000055ce31666570> #<Reference:0x000055ce31666390> #<Reference:0x000055ce31666098> #<Reference:0x000055ce31665e18> #<Reference:0x000055ce31665bc0> Anatidae Type 1 specific Anatidae 8830 Beefalo Type 1 specific Bos taurus X Bison bison 297284 Bison Type 1 specific Bison bison 9901 Buffalo Type 1 specific Bubalus bubalis 89462 Cattle (Beef, Veal) Type 1 specific Bos taurus 9913 Chicken Type 1 specific Gallus gallus 9031 Columbidae (Dove, Pigeon) Type 1 specific Columbidae 8930 Deer Type 1 specific Cervidae 9850 Domestic goat Type 1 specific Capra aegagrus hircus 9925 Domestic pig Type 1 specific Sus scrofa domestica 9825 Elk Type 1 specific Cervus canadensis 1574408 Emu Type 1 specific Dromaius novaehollandiae 8790 European rabbit Type 1 specific Oryctolagus 9984 Greylag goose Type 1 specific Anser anser 8843 Guinea hen Type 1 specific Numida meleagris 8996 Horse Type 1 specific Equus caballus 9796 Mallard duck Type 1 specific Anas platyrhynchos 8839 Mountain hare Type 1 specific Lepus timidus 62621 Mule deer Type 1 specific Odocoileus 9871 Ostrich Type 1 specific Struthio camelus 8801 Pheasant Type 1 specific Phasianus colchicus 9054 Quail Type 1 specific Phasianidae 9005 Rabbit Type 1 specific Leporidae 9979 Rock ptarmigan Type 1 specific Lagopus muta 64668 Sheep (Mutton, Lamb) Type 1 specific Ovis aries 9940 Squab Type 1 specific Columba 8931 Turkey Type 1 specific Meleagris gallopavo 9103 Velvet duck Type 1 specific Melanitta fusca 371864 Wild boar Type 1 specific Sus scrofa 9823