1.0 2011-09-21 00:12:39 UTC 2019-11-26 03:21:02 UTC FDB022354 DL-2-Aminooctanoic acid alpha-Aminooctanoic acid is an amino compound found occasionally in human urine. (PMID: 13447222) alpha-Aminooctanoic acid has been found in one case in the milk of a lactating mother at the 144th day of lactation. (Science and Culture (1960), 26 186-7.) [HMDB] (+-)-2-Aminooctanoate (+-)-2-Aminooctanoic acid (+/-)-2-amino-octanoate (+/-)-2-amino-octanoic acid (+/-)-2-aminooctanoate (+/-)-2-aminooctanoic acid 2-amino-dl-caprylate 2-amino-dl-caprylic acid 2-amino-dl-octanoate 2-amino-dl-octanoic acid 2-Aminocaprylate 2-Aminocaprylic acid 2-aminooctanoate 2-aminooctanoic acid a-Aminocaprylate a-Aminocaprylic acid a-Aminooctanoate a-Aminooctanoic acid alpha-Aminocaprylate alpha-Aminocaprylic acid alpha-Aminooctanoate alpha-Aminooctanoic acid D,L-2-Aminooctanoate D,L-2-Aminooctanoic acid dl-2-aminocaprylate dl-2-aminocaprylic acid DL-2-Aminooctanoate DL-2-Aminooctanoic acid DL-a-amino-N-Caprylate DL-a-amino-N-Caprylic acid DL-a-Aminocaprylate DL-a-Aminocaprylic acid dl-alpha-amino-n-caprylate dl-alpha-amino-n-caprylic acid DL-alpha-Aminocaprylate DL-alpha-Aminocaprylic acid DL-α-amino-N-caprylate DL-α-amino-N-caprylic acid DL-α-aminocaprylate DL-α-aminocaprylic acid NSC 20147 α-aminocaprylate α-aminocaprylic acid α-aminooctanoate α-aminooctanoic acid C8H17NO2 159.2261 159.125928793 2-aminooctanoic acid (+-)-2-aminooctanoic acid 644-90-6 CCCCCCC(N)C(O)=O InChI=1S/C8H17NO2/c1-2-3-4-5-6-7(9)8(10)11/h7H,2-6,9H2,1H3,(H,10,11) AKVBCGQVQXPRLD-UHFFFAOYSA-N belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon). Alpha amino acids Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Aliphatic acyclic compounds Amino acids Amino fatty acids Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Medium-chain fatty acids Monoalkylamines Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Aliphatic acyclic compound Alpha-amino acid Amine Amino acid Amino fatty acid Carbonyl group Carboxylic acid Fatty acid Fatty acyl Hydrocarbon derivative Medium-chain fatty acid Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary aliphatic amine Primary amine Amino fatty acids alpha-amino fatty acid Solid logp -0.99 ALOGPS logs -1.47 ALOGPS solubility 5.36e+00 g/l ALOGPS logp -0.54 ChemAxon pka_strongest_acidic 2.89 ChemAxon pka_strongest_basic 9.53 ChemAxon iupac 2-aminooctanoic acid ChemAxon average_mass 159.2261 ChemAxon mono_mass 159.125928793 ChemAxon smiles CCCCCCC(N)C(O)=O ChemAxon formula C8H17NO2 ChemAxon inchi InChI=1S/C8H17NO2/c1-2-3-4-5-6-7(9)8(10)11/h7H,2-6,9H2,1H3,(H,10,11) ChemAxon inchikey AKVBCGQVQXPRLD-UHFFFAOYSA-N ChemAxon polar_surface_area 63.32 ChemAxon refractivity 43.43 ChemAxon polarizability 18.72 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::NmrTwoD 1570 Specdb::NmrOneD 1629 Specdb::MsIr 1019 Specdb::MsIr 1020 Specdb::MsIr 1021 Specdb::CMs 9360 Specdb::CMs 37879 Specdb::CMs 135847 Specdb::CMs 143581 Specdb::CMs 1083122 Specdb::CMs 1083123 Specdb::CMs 1083124 Specdb::MsMs 1381 Specdb::MsMs 1382 Specdb::MsMs 1383 Specdb::MsMs 286666 Specdb::MsMs 286667 Specdb::MsMs 286668 Specdb::MsMs 325309 Specdb::MsMs 325310 Specdb::MsMs 325311 Specdb::MsMs 2235908 Specdb::MsMs 2237459 Specdb::MsMs 2244373 Specdb::MsMs 2245747 Specdb::MsMs 2246458 Specdb::MsMs 2247810 Specdb::MsMs 2248445 Specdb::MsMs 2249944 Specdb::MsMs 2250486 Specdb::MsMs 2251883 Specdb::MsMs 2839923 Specdb::MsMs 2839924 Specdb::MsMs 2839925 Specdb::MsMs 2869296 Specdb::MsMs 2869297 Specdb::MsMs 2869298 HMDB00991 #<Reference:0x000055ce2f6f6cd0> 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 Milk (Cow) Type 2 specific 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