1.0 2016-09-30 23:21:21 UTC 2020-04-22 15:17:13 UTC BMDB0006293 BMDB06293 L-Erythrulose L-Glycero-tetrulose (3S)-1,3,4-Trihydroxybutan-2-one Erythrulose Erythrulose, (R)-isomer C4H8O4 120.1039 120.042258744 (3S)-1,3,4-trihydroxybutan-2-one L-erythrulose 533-50-6 OC[C@H](O)C(=O)CO InChI=1S/C4H8O4/c5-1-3(7)4(8)2-6/h3,5-7H,1-2H2/t3-/m0/s1 UQPHVQVXLPRNCX-VKHMYHEASA-N belongs to the class of organic compounds known as monosaccharides. Monosaccharides are compounds containing one carbohydrate unit not glycosidically linked to another such unit, and no set of two or more glycosidically linked carbohydrate units. Monosaccharides have the general formula CnH2nOn. Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Monosaccharides Acyloins Alpha-hydroxy ketones Beta-hydroxy ketones Hydrocarbon derivatives Organic oxides Polyols Primary alcohols Secondary alcohols Acyloin Alcohol Aliphatic acyclic compound Alpha-hydroxy ketone Beta-hydroxy ketone Carbonyl group Hydrocarbon derivative Ketone Monosaccharide Organic oxide Polyol Primary alcohol Secondary alcohol Aliphatic acyclic compounds erythrulose Solid logp -1.97 ALOGPS logs 0.88 ALOGPS logp -2 ChemAxon pka_strongest_acidic 12.32 ChemAxon pka_strongest_basic -3 ChemAxon iupac (3S)-1,3,4-trihydroxybutan-2-one ChemAxon average_mass 120.1039 ChemAxon mono_mass 120.042258744 ChemAxon smiles OC[C@H](O)C(=O)CO ChemAxon formula C4H8O4 ChemAxon inchi InChI=1S/C4H8O4/c5-1-3(7)4(8)2-6/h3,5-7H,1-2H2/t3-/m0/s1 ChemAxon inchikey UQPHVQVXLPRNCX-VKHMYHEASA-N ChemAxon polar_surface_area 77.76 ChemAxon refractivity 25.64 ChemAxon polarizability 10.95 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 0 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::MsMs 300781 Specdb::MsMs 300782 Specdb::MsMs 300783 Specdb::MsMs 343135 Specdb::MsMs 343136 Specdb::MsMs 343137 Specdb::MsMs 2288505 Specdb::MsMs 2288506 Specdb::MsMs 2288507 Specdb::MsMs 2647323 Specdb::MsMs 2647324 Specdb::MsMs 2647325 Specdb::CMs 15697 Specdb::CMs 38995 Specdb::CMs 149877 Specdb::NmrOneD 10922 Specdb::NmrOneD 10923 Specdb::NmrOneD 10924 Specdb::NmrOneD 10925 Specdb::NmrOneD 10926 Specdb::NmrOneD 10927 Specdb::NmrOneD 10928 Specdb::NmrOneD 10929 Specdb::NmrOneD 10930 Specdb::NmrOneD 10931 Specdb::NmrOneD 10932 Specdb::NmrOneD 10933 Specdb::NmrOneD 10934 Specdb::NmrOneD 10935 Specdb::NmrOneD 10936 Specdb::NmrOneD 10937 Specdb::NmrOneD 10938 Specdb::NmrOneD 10939 Specdb::NmrOneD 10940 Specdb::NmrOneD 10941 Specdb::MsIr 2389 Specdb::MsIr 2390 Specdb::MsIr 2391 4573719 FDB023881 5460032 C02045 27913 LER ERYTHRULOSE 38964 Erythrulose Muller, H.; Montigel, C.; Reichstein, T. Pure l-erythrulose (1,2-ketotetrose). Helvetica Chimica Acta (1937), 20 1468-73.