1.0 2010-04-08 22:08:09 UTC 2025-11-18 23:11:59 UTC FDB008583 Phaseolic acid Isolated from dry bean seeds (Phaseolus species). Phaseolic acid is found in pulses. 5,8(9),12-Trihydroxy-2-oxododecanoic acid C12H22O6 262.2995 262.141638436 5,8,12-trihydroxy-2-oxododecanoic acid 5,8,12-trihydroxy-2-oxododecanoic acid 29533-15-1 OCCCCC(O)CCC(O)CCC(=O)C(O)=O InChI=1S/C12H22O6/c13-8-2-1-3-9(14)4-5-10(15)6-7-11(16)12(17)18/h9-10,13-15H,1-8H2,(H,17,18) OPPXDBWFRYVXHW-UHFFFAOYSA-N belongs to the class of organic compounds known as medium-chain keto acids and derivatives. These are keto acids with a 6 to 12 carbon atoms long side chain. Medium-chain keto acids and derivatives Organic compounds Organic acids and derivatives Keto acids and derivatives Medium-chain keto acids and derivatives Aliphatic acyclic compounds Alpha-hydroxy ketones Alpha-keto acids and derivatives Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Polyols Primary alcohols Secondary alcohols Alcohol Aliphatic acyclic compound Alpha-hydroxy ketone Alpha-keto acid Carbonyl group Carboxylic acid Carboxylic acid derivative Hydrocarbon derivative Ketone Medium-chain keto acid Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Polyol Primary alcohol Secondary alcohol logp -0.38 ALOGPS logs -1.86 ALOGPS solubility 3.60e+00 g/l ALOGPS logp 0.11 ChemAxon pka_strongest_acidic 3.26 ChemAxon pka_strongest_basic -2 ChemAxon iupac 5,8,12-trihydroxy-2-oxododecanoic acid ChemAxon average_mass 262.2995 ChemAxon mono_mass 262.141638436 ChemAxon smiles OCCCCC(O)CCC(O)CCC(=O)C(O)=O ChemAxon formula C12H22O6 ChemAxon inchi InChI=1S/C12H22O6/c13-8-2-1-3-9(14)4-5-10(15)6-7-11(16)12(17)18/h9-10,13-15H,1-8H2,(H,17,18) ChemAxon inchikey OPPXDBWFRYVXHW-UHFFFAOYSA-N ChemAxon polar_surface_area 115.06 ChemAxon refractivity 64.69 ChemAxon polarizability 28.06 ChemAxon rotatable_bond_count 11 ChemAxon acceptor_count 6 ChemAxon donor_count 4 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22619 Specdb::CMs 42652 Specdb::CMs 155625 Specdb::MsMs 83682 Specdb::MsMs 83683 Specdb::MsMs 83684 Specdb::MsMs 145329 Specdb::MsMs 145330 Specdb::MsMs 145331 Specdb::MsMs 2708303 Specdb::MsMs 2708304 Specdb::MsMs 2708305 Specdb::MsMs 3001309 Specdb::MsMs 3001310 Specdb::MsMs 3001311 Specdb::NmrOneD 20122 Specdb::NmrOneD 20123 Specdb::NmrOneD 20124 Specdb::NmrOneD 20125 Specdb::NmrOneD 20126 Specdb::NmrOneD 20127 Specdb::NmrOneD 20128 Specdb::NmrOneD 20129 Specdb::NmrOneD 20130 Specdb::NmrOneD 20131 Specdb::NmrOneD 20132 Specdb::NmrOneD 20133 Specdb::NmrOneD 20134 Specdb::NmrOneD 20135 Specdb::NmrOneD 20136 Specdb::NmrOneD 20137 Specdb::NmrOneD 20138 Specdb::NmrOneD 20139 Specdb::NmrOneD 20140 Specdb::NmrOneD 20141 HMDB31897 #<Reference:0x000055ce32b15d40> Pulses Unknown generic