1.0 2016-09-30 22:28:29 UTC 2020-04-22 15:02:55 UTC BMDB0000317 BMDB00317 2-Hydroxy-3-methylpentanoic acid 2-Hydroxy-3-methylpentanoate (2R,3R)-2-Hydroxy-3-methyl-pentanoate (2R,3R)-2-Hydroxy-3-methyl-pentanoic acid (2R,3R)-2-Hydroxy-3-methylpentanoate (2R,3R)-2-Hydroxy-3-methylpentanoic acid 2-Hydroxy-3-methyl-pentanoate 2-Hydroxy-3-methyl-pentanoic acid 2-Hydroxy-3-methyl-valerate 2-Hydroxy-3-methyl-valeric acid 2-Hydroxy-3-methylvalerate 2-Hydroxy-3-methylvaleric acid a-Hydroxy-b-methylvalerate a-Hydroxy-b-methylvaleric acid alpha-Hydroxy-beta-methylvalerate alpha-Hydroxy-beta-methylvaleric acid HMVA C6H12O3 132.1577 132.07864425 (2R,3R)-2-hydroxy-3-methylpentanoic acid 2-hydroxy-3-methyl-valerate 488-15-3 CC[C@@H](C)[C@@H](O)C(O)=O InChI=1S/C6H12O3/c1-3-4(2)5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/t4-,5-/m1/s1 RILPIWOPNGRASR-RFZPGFLSSA-N belongs to the class of organic compounds known as hydroxy fatty acids. These are fatty acids in which the chain bears a hydroxyl group. Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acids and conjugates Hydroxy fatty acids Alpha hydroxy acids and derivatives Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Methyl-branched fatty acids Monocarboxylic acids and derivatives Monosaccharides Organic oxides Secondary alcohols Alcohol Aliphatic acyclic compound Alpha-hydroxy acid Branched fatty acid Carbonyl group Carboxylic acid Carboxylic acid derivative Hydrocarbon derivative Hydroxy acid Hydroxy fatty acid Methyl-branched fatty acid Monocarboxylic acid or derivatives Monosaccharide Organic oxide Organic oxygen compound Organooxygen compound Secondary alcohol Aliphatic acyclic compounds Hydroxy fatty acids Solid logp 0.74 ALOGPS logs 0.05 ALOGPS logp 0.86 ChemAxon pka_strongest_acidic 4.25 ChemAxon pka_strongest_basic -3.9 ChemAxon iupac (2R,3R)-2-hydroxy-3-methylpentanoic acid ChemAxon average_mass 132.1577 ChemAxon mono_mass 132.07864425 ChemAxon smiles CC[C@@H](C)[C@@H](O)C(O)=O ChemAxon formula C6H12O3 ChemAxon inchi InChI=1S/C6H12O3/c1-3-4(2)5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/t4-,5-/m1/s1 ChemAxon inchikey RILPIWOPNGRASR-RFZPGFLSSA-N ChemAxon polar_surface_area 57.53 ChemAxon refractivity 32.44 ChemAxon polarizability 13.77 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge -1 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 28841 Specdb::MsMs 28842 Specdb::MsMs 28843 Specdb::MsMs 35399 Specdb::MsMs 35400 Specdb::MsMs 35401 Specdb::MsMs 2244382 Specdb::MsMs 2245709 Specdb::MsMs 2246546 Specdb::MsMs 2816995 Specdb::MsMs 2816996 Specdb::MsMs 2816997 Specdb::MsMs 2888338 Specdb::MsMs 2888339 Specdb::MsMs 2888340 Specdb::CMs 2976 Specdb::CMs 37425 Specdb::CMs 166941 Specdb::CMs 1058130 Specdb::CMs 1058132 Specdb::CMs 1058134 Specdb::CMs 1058135 Specdb::CMs 1058137 Specdb::MsIr 404 Specdb::MsIr 405 Specdb::MsIr 406 Specdb::NmrOneD 340248 Specdb::NmrOneD 340249 Specdb::NmrOneD 340250 Specdb::NmrOneD 340251 Specdb::NmrOneD 340252 Specdb::NmrOneD 340253 Specdb::NmrOneD 340254 Specdb::NmrOneD 340255 Specdb::NmrOneD 340256 Specdb::NmrOneD 340257 Specdb::NmrOneD 340258 Specdb::NmrOneD 340259 Specdb::NmrOneD 340260 Specdb::NmrOneD 340261 Specdb::NmrOneD 340262 Specdb::NmrOneD 340263 Specdb::NmrOneD 340264 Specdb::NmrOneD 340265 Specdb::NmrOneD 340266 Specdb::NmrOneD 340267 8972081 FDB021944 10796774 89228 C00052119 5306 Mamer, O.A. & Reimer, M.L.J. "On the Mechanisms of the Formation of L-Alloisoleucine and the 2-Hydroxy-3-methylvaleric Acid.." J. Biol. Chem. 267: 22141-22147 (1992).