1.0 2010-04-08 22:05:18 UTC 2019-11-26 02:57:15 UTC FDB002261 D-Threitol Found in the edible fungus Armillaria mellea. Constituent of jute (Corchorus capsularis and Corchorus olitorius (Jew's mallow)), and the pigeon pea plant (Cajanus cajan). Threitol in the urine is a biomarker for the consumption of apples and other fruits. (-)-Threitol (2R,3R)-1,2,3,4-Butanetetrol (2R,3R)-Butane-1,2,3,4-tetrol (R*,r*)-1,2,3,4-butanetetrol D-Threitol D-threo-Tetritol Threit Threitol Threitol; D-form C4H10O4 122.1198 122.057908808 (2R,3R)-butane-1,2,3,4-tetrol (-)-threitol 2418-52-2 OCC(O)C(O)CO InChI=1S/C4H10O4/c5-1-3(7)4(8)2-6/h3-8H,1-2H2 UNXHWFMMPAWVPI-UHFFFAOYSA-N belongs to the class of organic compounds known as sugar alcohols. These are hydrogenated forms of carbohydrate in which the carbonyl group (aldehyde or ketone, reducing sugar) has been reduced to a primary or secondary hydroxyl group. Sugar alcohols Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Aliphatic acyclic compounds Hydrocarbon derivatives Polyols Primary alcohols Secondary alcohols Alcohol Aliphatic acyclic compound Hydrocarbon derivative Polyol Primary alcohol Secondary alcohol Sugar alcohol threitol Solid melting_point Mp 88.5-89° logp -2.5 ChemAxon pka_strongest_acidic 13.04 ChemAxon pka_strongest_basic -3 ChemAxon iupac (2R,3R)-butane-1,2,3,4-tetrol ChemAxon average_mass 122.1198 ChemAxon mono_mass 122.057908808 ChemAxon smiles OCC(O)C(O)CO ChemAxon formula C4H10O4 ChemAxon inchi InChI=1S/C4H10O4/c5-1-3(7)4(8)2-6/h3-8H,1-2H2 ChemAxon inchikey UNXHWFMMPAWVPI-UHFFFAOYSA-N ChemAxon polar_surface_area 80.92 ChemAxon refractivity 26.48 ChemAxon polarizability 11.66 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 4 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::NmrOneD 1993 Specdb::EiMs 1996 Specdb::NmrTwoD 1928 Specdb::CMs 874 Specdb::CMs 9336 Specdb::CMs 30152 Specdb::CMs 30699 Specdb::CMs 31899 Specdb::CMs 38721 Specdb::CMs 165835 Specdb::MsMs 58710 Specdb::MsMs 58711 Specdb::MsMs 58712 Specdb::MsMs 114702 Specdb::MsMs 114703 Specdb::MsMs 114704 Specdb::MsMs 1218193 Specdb::MsMs 1218194 Specdb::MsMs 1218195 Specdb::MsMs 2236324 Specdb::MsMs 2238456 Specdb::MsMs 2239105 Specdb::MsMs 2454106 Specdb::MsMs 2454107 Specdb::MsMs 2454108 Specdb::MsMs 2485326 Specdb::MsMs 2485327 Specdb::MsMs 2485328 HMDB04136 48300 #<Reference:0x000055ce32aabd78> #<Reference:0x000055ce32aabb98> #<Reference:0x000055ce32aab9b8> 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 Caraway Type 1 specific Carum carvi 48032 Cattle (Beef, Veal) Type 1 specific Bos taurus 9913 Chicken Type 1 specific Gallus gallus 9031 Columbidae (Dove, Pigeon) Type 1 specific Columbidae 8930 Common mushroom Type 1 specific Agaricus bisporus 5341 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 Mushrooms Unknown generic Ostrich Type 1 specific Struthio camelus 8801 Oyster mushroom Type 1 specific Pleurotus ostreatus 5322 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