1.0 2020-03-03 19:28:48 UTC 2020-04-22 15:55:47 UTC BMDB0063895 BMDB63895 Glycyl-Gamma-glutamate Glycyl-g-glutamate Glycyl-g-glutamic acid Glycyl-gamma-glutamic acid Glycyl-γ-glutamate Glycyl-γ-glutamic acid g-GE dipeptide GGE dipeptide Gly-gglu Glycine gamma-glutamate dipeptide Glycine-gamma-glutamate dipeptide Glycylgamma-glutamate L-Glycyl-L-gamma-glutamate 2-Amino-4-[(2-aminoacetyl)-C-hydroxycarbonimidoyl]butanoate C7H13N3O4 203.1958 203.090605919 2-amino-4-[(2-aminoacetyl)carbamoyl]butanoic acid 2-amino-4-[(2-aminoacetyl)carbamoyl]butanoic acid NCC(=O)NC(=O)CCC(N)C(O)=O InChI=1S/C7H13N3O4/c8-3-6(12)10-5(11)2-1-4(9)7(13)14/h4H,1-3,8-9H2,(H,13,14)(H,10,11,12) WNDNXCYHNXBXNK-UHFFFAOYSA-N belongs to the class of organic compounds known as glutamine and derivatives. Glutamine and derivatives are compounds containing glutamine or a derivative thereof resulting from reaction of glutamine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Glutamine and derivatives Alpha amino acid amides Alpha amino acids Amino acids Carbonyl compounds Carboxylic acids Dicarboximides Fatty acids and conjugates Hydrocarbon derivatives Monoalkylamines Monocarboxylic acids and derivatives N-acyl amines N-unsubstituted carboxylic acid imides Organic oxides Organopnictogen compounds Aliphatic acyclic compound Alpha-amino acid Alpha-amino acid amide Amine Amino acid Carbonyl group Carboxylic acid Carboxylic acid imide Carboxylic acid imide, n-unsubstituted Dicarboximide Fatty acid Glutamine or derivatives Hydrocarbon derivative Monocarboxylic acid or derivatives N-acyl-amine Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary aliphatic amine Primary amine Aliphatic acyclic compounds logp -3.30 ALOGPS logs -1.07 ALOGPS logp -5 ChemAxon pka_strongest_acidic 2.02 ChemAxon pka_strongest_basic 9.41 ChemAxon iupac 2-amino-4-[(2-aminoacetyl)carbamoyl]butanoic acid ChemAxon average_mass 203.1958 ChemAxon mono_mass 203.090605919 ChemAxon smiles NCC(=O)NC(=O)CCC(N)C(O)=O ChemAxon formula C7H13N3O4 ChemAxon inchi InChI=1S/C7H13N3O4/c8-3-6(12)10-5(11)2-1-4(9)7(13)14/h4H,1-3,8-9H2,(H,13,14)(H,10,11,12) ChemAxon inchikey WNDNXCYHNXBXNK-UHFFFAOYSA-N ChemAxon polar_surface_area 135.51 ChemAxon refractivity 46.04 ChemAxon polarizability 19.35 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 6 ChemAxon donor_count 4 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::CMs 15241 Specdb::CMs 40913 Specdb::CMs 130467 Specdb::CMs 138201 Specdb::NmrOneD 105838 Specdb::NmrOneD 105839 Specdb::NmrOneD 105840 Specdb::NmrOneD 105841 Specdb::NmrOneD 105842 Specdb::NmrOneD 105843 Specdb::NmrOneD 105844 Specdb::NmrOneD 105845 Specdb::NmrOneD 105846 Specdb::NmrOneD 105847 Specdb::NmrOneD 105848 Specdb::NmrOneD 105849 Specdb::NmrOneD 105850 Specdb::NmrOneD 105851 Specdb::NmrOneD 105852 Specdb::NmrOneD 105853 Specdb::NmrOneD 105854 Specdb::NmrOneD 105855 Specdb::NmrOneD 105856 Specdb::NmrOneD 105857 Specdb::MsMs 299806 Specdb::MsMs 299807 Specdb::MsMs 299808 Specdb::MsMs 341917 Specdb::MsMs 341918 Specdb::MsMs 341919 Specdb::MsMs 2663359 Specdb::MsMs 2663360 Specdb::MsMs 2663361 Specdb::MsMs 3014686 Specdb::MsMs 3014687 Specdb::MsMs 3014688 FDB111887 35032796 87557032 169905