1.0 2010-04-08 22:04:53 UTC 2025-11-18 22:29:16 UTC FDB001228 Pangamic acid Isolated from apricot kernel, also said to be present in cereals etc. Said to be a vitamin of significance in, inter alia, hypertension control Pangamic acid is also known as vitamin B15, but it is not widely accepted as a vitamin for it has not been shown to be essential in the human diet, and a deficiency in consumption of pangamic acid is not known to be associated with any disease.; Pangamic acid is an ester derived from gluconic acid and dimethylglycine. It was first isolated by Ernst T. Krebs from apricot kernels, and has since been identified in some foods such as pulsesand is also found in rice bran & apricot kernels. 6-(Bis(bis(isopropyl)amino)acetate)-D-gluconic acid D-Gluconic acid 6-bis(diisopropylamino)acetate D-Gluconic acid 6-bis[bis(1-methylethyl)amino]acetate, 9CI D-Gluconic acid, 6-(bis(1-methylethyl)amino)acetate) Dimethyl-amino-acetylgluconic acid Gluconic acid, 6-(bis(diisopropylamino)acetate) Vitamin B15 Vitamin B15, 8CI C20H40N2O8 436.5402 436.278466266 6-({2,2-bis[bis(propan-2-yl)amino]acetyl}oxy)-2,3,4,5-tetrahydroxyhexanoic acid 6-{[2,2-bis(diisopropylamino)acetyl]oxy}-2,3,4,5-tetrahydroxyhexanoic acid 11006-56-7 CC(C)N(C(C)C)C(N(C(C)C)C(C)C)C(=O)OCC(O)C(O)C(O)C(O)C(O)=O InChI=1S/C20H40N2O8/c1-10(2)21(11(3)4)18(22(12(5)6)13(7)8)20(29)30-9-14(23)15(24)16(25)17(26)19(27)28/h10-18,23-26H,9H2,1-8H3,(H,27,28) RVSTWRHIGKXTLG-UHFFFAOYSA-N belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids. Alpha amino acid esters Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Aliphatic acyclic compounds Alpha hydroxy acids and derivatives Amino fatty acids Beta hydroxy acids and derivatives Carbonyl compounds Carboxylic acid esters Carboxylic acids Dicarboxylic acids and derivatives Hydrocarbon derivatives Hydroxy fatty acids Medium-chain fatty acids Medium-chain hydroxy acids and derivatives Monosaccharides Organic oxides Organonitrogen compounds Organopnictogen compounds Polyols Secondary alcohols Alcohol Aliphatic acyclic compound Alpha-amino acid ester Alpha-hydroxy acid Amino fatty acid Beta-hydroxy acid Carbonyl group Carboxylic acid Carboxylic acid ester Dicarboxylic acid or derivatives Fatty acid Fatty acyl Hydrocarbon derivative Hydroxy acid Hydroxy fatty acid Medium-chain fatty acid Medium-chain hydroxy acid Monosaccharide Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Polyol Secondary alcohol logp 1.35 ALOGPS logs -1.34 ALOGPS solubility 1.98e+01 g/l ALOGPS logp -2.2 ChemAxon pka_strongest_acidic 2.66 ChemAxon pka_strongest_basic 6.25 ChemAxon iupac 6-({2,2-bis[bis(propan-2-yl)amino]acetyl}oxy)-2,3,4,5-tetrahydroxyhexanoic acid ChemAxon average_mass 436.5402 ChemAxon mono_mass 436.278466266 ChemAxon smiles CC(C)N(C(C)C)C(N(C(C)C)C(C)C)C(=O)OCC(O)C(O)C(O)C(O)C(O)=O ChemAxon formula C20H40N2O8 ChemAxon inchi InChI=1S/C20H40N2O8/c1-10(2)21(11(3)4)18(22(12(5)6)13(7)8)20(29)30-9-14(23)15(24)16(25)17(26)19(27)28/h10-18,23-26H,9H2,1-8H3,(H,27,28) ChemAxon inchikey RVSTWRHIGKXTLG-UHFFFAOYSA-N ChemAxon polar_surface_area 151 ChemAxon refractivity 110.45 ChemAxon polarizability 45.89 ChemAxon rotatable_bond_count 14 ChemAxon acceptor_count 9 ChemAxon donor_count 5 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 19315 Specdb::CMs 41657 Specdb::CMs 165103 Specdb::MsMs 7565 Specdb::MsMs 7566 Specdb::MsMs 7567 Specdb::MsMs 14237 Specdb::MsMs 14238 Specdb::MsMs 14239 Specdb::MsMs 2469502 Specdb::MsMs 2469503 Specdb::MsMs 2469504 Specdb::MsMs 2492165 Specdb::MsMs 2492166 Specdb::MsMs 2492167 Specdb::NmrOneD 160330 Specdb::NmrOneD 160331 Specdb::NmrOneD 160332 Specdb::NmrOneD 160333 Specdb::NmrOneD 160334 Specdb::NmrOneD 160335 Specdb::NmrOneD 160336 Specdb::NmrOneD 160337 Specdb::NmrOneD 160338 Specdb::NmrOneD 160339 Specdb::NmrOneD 160340 Specdb::NmrOneD 160341 Specdb::NmrOneD 160342 Specdb::NmrOneD 160343 Specdb::NmrOneD 160344 Specdb::NmrOneD 160345 Specdb::NmrOneD 160346 Specdb::NmrOneD 160347 Specdb::NmrOneD 160348 Specdb::NmrOneD 160349 HMDB29949 Apricot Type 1 specific Prunus armeniaca 36596 Breakfast cereal Type 2 specific Cereals and cereal products Unknown generic Fruits Unknown generic Rice Type 1 specific Oryza sativa 4530 Hepatoprotective 981 Any compound that is able to prevent damage to the liver.