1.0 2010-04-08 22:14:04 UTC 2019-11-26 03:16:58 UTC FDB018984 N2-(3-Carboxy-2-hydroxy-1-oxopropyl)arginine Constituent of the seeds of Vicia faba and the shoots of apple and pear trees. N2-(3-Carboxy-2-hydroxy-1-oxopropyl)arginine is found in pomes and pulses. N2-(2-Hydroxysuccinoyl)arginine N2-(3-Carboxy-2-hydroxy-1-oxopropyl)arginine C10H18N4O6 290.2731 290.122634328 (2S)-5-carbamimidamido-2-[(3-carboxy-1,2-dihydroxypropylidene)amino]pentanoic acid (2S)-5-carbamimidamido-2-[(3-carboxy-1,2-dihydroxypropylidene)amino]pentanoic acid 87605-92-3 NC(=N)NCCC[C@H](NC(=O)C(O)CC(O)=O)C(O)=O InChI=1S/C10H18N4O6/c11-10(12)13-3-1-2-5(9(19)20)14-8(18)6(15)4-7(16)17/h5-6,15H,1-4H2,(H,14,18)(H,16,17)(H,19,20)(H4,11,12,13)/t5-,6?/m0/s1 JRDIRZIEGSCMRP-ZBHICJROSA-N belongs to the class of organic compounds known as arginine and derivatives. Arginine and derivatives are compounds containing arginine or a derivative thereof resulting from reaction of arginine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Arginine and derivatives Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Aliphatic acyclic compounds Beta hydroxy acids and derivatives Carbonyl compounds Carboximidamides Carboxylic acids Dicarboxylic acids and derivatives Fatty acids and conjugates Guanidines Hydrocarbon derivatives Imines N-acyl amines N-acyl-L-alpha-amino acids Organic oxides Organopnictogen compounds Secondary alcohols Secondary carboxylic acid amides Short-chain hydroxy acids and derivatives Alcohol Aliphatic acyclic compound Arginine or derivatives Beta-hydroxy acid Carbonyl group Carboxamide group Carboximidamide Carboxylic acid Dicarboxylic acid or derivatives Fatty acid Fatty acyl Fatty amide Guanidine Hydrocarbon derivative Hydroxy acid Imine N-acyl-alpha amino acid or derivatives N-acyl-alpha-amino acid N-acyl-amine N-acyl-l-alpha-amino acid Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Secondary alcohol Secondary carboxylic acid amide Short-chain hydroxy acid logp -1.61 ALOGPS logs -2.90 ALOGPS solubility 3.65e-01 g/l ALOGPS logp -3.7 ChemAxon pka_strongest_acidic 2.95 ChemAxon pka_strongest_basic 12.09 ChemAxon iupac (2S)-5-carbamimidamido-2-[(3-carboxy-1,2-dihydroxypropylidene)amino]pentanoic acid ChemAxon average_mass 290.2731 ChemAxon mono_mass 290.122634328 ChemAxon smiles NC(=N)NCCC[C@H](NC(=O)C(O)CC(O)=O)C(O)=O ChemAxon formula C10H18N4O6 ChemAxon inchi InChI=1S/C10H18N4O6/c11-10(12)13-3-1-2-5(9(19)20)14-8(18)6(15)4-7(16)17/h5-6,15H,1-4H2,(H,14,18)(H,16,17)(H,19,20)(H4,11,12,13)/t5-,6?/m0/s1 ChemAxon inchikey JRDIRZIEGSCMRP-ZBHICJROSA-N ChemAxon polar_surface_area 189.32 ChemAxon refractivity 76.12 ChemAxon polarizability 27.4 ChemAxon rotatable_bond_count 9 ChemAxon acceptor_count 10 ChemAxon donor_count 7 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 48960 Specdb::MsMs 48961 Specdb::MsMs 48962 Specdb::MsMs 170508 Specdb::MsMs 170509 Specdb::MsMs 170510 HMDB39408 #<Reference:0x000055ce32d842e8> Pomes Unknown generic Pulses Unknown generic