1.0 2016-10-03 18:34:59 UTC 2020-04-22 15:49:18 UTC BMDB0012251 BMDB12251 L-Canaline (2S)-2-Amino-4-(aminooxy)butanoic acid (2S)-2-Amino-4-(aminooxy)butyric acid Canaline L-2-Amino-4-(aminooxy)butyric acid (2S)-2-Amino-4-(aminooxy)butanoate (2S)-2-Amino-4-(aminooxy)butyrate L-2-Amino-4-(aminooxy)butyrate L-a-Amino-g-(aminooxy)-N-butyric acid L-alpha-Amino-gamma-(aminooxy)-N-butyric acid 1-Amino-3-amino-oxybutyric acid L-Canaline C4H10N2O3 134.1338 134.069142196 (2S)-2-amino-4-(aminooxy)butanoic acid canaline 496-93-5 NOCC[C@H](N)C(O)=O InChI=1S/C4H10N2O3/c5-3(4(7)8)1-2-9-6/h3H,1-2,5-6H2,(H,7,8)/t3-/m0/s1 FQPGMQABJNQLLF-VKHMYHEASA-N belongs to the class of organic compounds known as l-alpha-amino acids. These are alpha amino acids which have the L-configuration of the alpha-carbon atom. Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues L-alpha-amino acids Amino acids Carbonyl compounds Carboxylic acids Fatty acids and conjugates Hydrocarbon derivatives Monoalkylamines Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Aliphatic acyclic compound Amine Amino acid Carbonyl group Carboxylic acid Fatty acid Hydrocarbon derivative L-alpha-amino acid Monocarboxylic acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary aliphatic amine Primary amine Aliphatic acyclic compounds non-proteinogenic L-alpha-amino acid Solid logp -3.21 ALOGPS logs 0.36 ALOGPS logp -3.7 ChemAxon pka_strongest_acidic 2.24 ChemAxon pka_strongest_basic 9.46 ChemAxon iupac (2S)-2-amino-4-(aminooxy)butanoic acid ChemAxon average_mass 134.1338 ChemAxon mono_mass 134.069142196 ChemAxon smiles NOCC[C@H](N)C(O)=O ChemAxon formula C4H10N2O3 ChemAxon inchi InChI=1S/C4H10N2O3/c5-3(4(7)8)1-2-9-6/h3H,1-2,5-6H2,(H,7,8)/t3-/m0/s1 ChemAxon inchikey FQPGMQABJNQLLF-VKHMYHEASA-N ChemAxon polar_surface_area 98.57 ChemAxon refractivity 30.98 ChemAxon polarizability 12.91 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge 0 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::MsIr 2735 Specdb::MsIr 2736 Specdb::MsIr 2737 Specdb::CMs 7878 Specdb::CMs 39886 Specdb::CMs 146756 Specdb::MsMs 256470 Specdb::MsMs 256471 Specdb::MsMs 256472 Specdb::MsMs 276411 Specdb::MsMs 276412 Specdb::MsMs 276413 Specdb::MsMs 2418849 Specdb::MsMs 2418850 Specdb::MsMs 2418851 Specdb::MsMs 2544160 Specdb::MsMs 2544161 Specdb::MsMs 2544162 Specdb::NmrOneD 96678 Specdb::NmrOneD 96679 Specdb::NmrOneD 96680 Specdb::NmrOneD 96681 Specdb::NmrOneD 96682 Specdb::NmrOneD 96683 Specdb::NmrOneD 96684 Specdb::NmrOneD 96685 Specdb::NmrOneD 96686 Specdb::NmrOneD 96687 Specdb::NmrOneD 96688 Specdb::NmrOneD 96689 Specdb::NmrOneD 96690 Specdb::NmrOneD 96691 Specdb::NmrOneD 96692 Specdb::NmrOneD 96693 Specdb::NmrOneD 96694 Specdb::NmrOneD 96695 Specdb::NmrOneD 96696 Specdb::NmrOneD 96697 FDB030959 C08270 DB02821 390176 441443 41401 C00001346 L-CANALINE Canaline