1.0 2010-04-08 22:13:20 UTC 2019-11-26 03:15:17 UTC FDB017817 N,N'-Bis(gamma-glutamyl)cystine Isolated from chives (Allium schoenoprasum) and from shiitake mushrooms (Lentinus edodes). N,N'-Bis(gamma-glutamyl)cystine is found in mushrooms and onion-family vegetables. Bis-g-glutamylcystine Bis-g-L-glutamyl-L-cystine Bis-gamma-glutamylcystine Bis-gamma-L-glutamyl-L-cystine Bis-γ-glutamylcystine Bis-γ-L-glutamyl-L-cystine g-Glutamylcysteine (2->2')disulfide, 9CI Gamma-glu-CYS disulfide L-Cysteine, L-gamma-glutamyl-, (2-2')-disulfide N-g-Glutamylcystine N,N'-Bis(g-glutamyl)cystine Oxidized g-glutamylcysteine Oxidized g-L-glutamyl-L-cysteine Oxidized gamma-glutamylcysteine Oxidized gamma-L-glutamyl-L-cysteine Oxidized γ-glutamylcysteine Oxidized γ-L-glutamyl-L-cysteine C16H26N4O10S2 498.528 498.109034452 2-amino-4-[(2-{[2-(4-amino-4-carboxybutanamido)-2-carboxyethyl]disulfanyl}-1-carboxyethyl)carbamoyl]butanoic acid bis-gamma-glutamylcystine 23052-19-9 NC(CCC(=O)NC(CSSCC(NC(=O)CCC(N)C(O)=O)C(O)=O)C(O)=O)C(O)=O InChI=1S/C16H26N4O10S2/c17-7(13(23)24)1-3-11(21)19-9(15(27)28)5-31-32-6-10(16(29)30)20-12(22)4-2-8(18)14(25)26/h7-10H,1-6,17-18H2,(H,19,21)(H,20,22)(H,23,24)(H,25,26)(H,27,28)(H,29,30) GOZJYXJJQVGDOJ-UHFFFAOYSA-N belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Dipeptides Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Aliphatic acyclic compounds Alpha amino acids Amino acids Carbonyl compounds Carboxylic acids Cysteine and derivatives Dialkyldisulfides Gamma-glutamyl amino acids Glutamine and derivatives Hydrocarbon derivatives Monoalkylamines N-acyl amines N-acyl-alpha amino acids Organic oxides Organopnictogen compounds Secondary carboxylic acid amides Sulfenyl compounds Tetracarboxylic acids and derivatives Aliphatic acyclic compound Alpha-amino acid Alpha-amino acid or derivatives Alpha-dipeptide Amine Amino acid Amino acid or derivatives Carbonyl group Carboxamide group Carboxylic acid Cysteine or derivatives Dialkyldisulfide Fatty acyl Fatty amide Gamma-glutamyl alpha-amino acid Glutamine or derivatives Hydrocarbon derivative N-acyl-alpha amino acid or derivatives N-acyl-alpha-amino acid N-acyl-amine Organic disulfide Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Organosulfur compound Primary aliphatic amine Primary amine Secondary carboxylic acid amide Sulfenyl compound Tetracarboxylic acid or derivatives gamma-glutamylcysteine logp -3.62 ALOGPS logs -2.93 ALOGPS solubility 5.79e-01 g/l ALOGPS logp -7.9 ChemAxon pka_strongest_acidic 1.4 ChemAxon pka_strongest_basic 9.61 ChemAxon iupac 2-amino-4-[(2-{[2-(4-amino-4-carboxybutanamido)-2-carboxyethyl]disulfanyl}-1-carboxyethyl)carbamoyl]butanoic acid ChemAxon average_mass 498.528 ChemAxon mono_mass 498.109034452 ChemAxon smiles NC(CCC(=O)NC(CSSCC(NC(=O)CCC(N)C(O)=O)C(O)=O)C(O)=O)C(O)=O ChemAxon formula C16H26N4O10S2 ChemAxon inchi InChI=1S/C16H26N4O10S2/c17-7(13(23)24)1-3-11(21)19-9(15(27)28)5-31-32-6-10(16(29)30)20-12(22)4-2-8(18)14(25)26/h7-10H,1-6,17-18H2,(H,19,21)(H,20,22)(H,23,24)(H,25,26)(H,27,28)(H,29,30) ChemAxon inchikey GOZJYXJJQVGDOJ-UHFFFAOYSA-N ChemAxon polar_surface_area 259.44 ChemAxon refractivity 111.05 ChemAxon polarizability 46.79 ChemAxon rotatable_bond_count 17 ChemAxon acceptor_count 12 ChemAxon donor_count 8 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 14926 Specdb::CMs 45833 Specdb::CMs 130609 Specdb::CMs 138343 Specdb::MsMs 55554 Specdb::MsMs 55555 Specdb::MsMs 55556 Specdb::MsMs 110739 Specdb::MsMs 110740 Specdb::MsMs 110741 Specdb::MsMs 2675833 Specdb::MsMs 2675834 Specdb::MsMs 2675835 Specdb::MsMs 3029120 Specdb::MsMs 3029121 Specdb::MsMs 3029122 Specdb::NmrOneD 26722 Specdb::NmrOneD 26723 Specdb::NmrOneD 26724 Specdb::NmrOneD 26725 Specdb::NmrOneD 26726 Specdb::NmrOneD 26727 Specdb::NmrOneD 26728 Specdb::NmrOneD 26729 Specdb::NmrOneD 26730 Specdb::NmrOneD 26731 Specdb::NmrOneD 26732 Specdb::NmrOneD 26733 Specdb::NmrOneD 26734 Specdb::NmrOneD 26735 Specdb::NmrOneD 26736 Specdb::NmrOneD 26737 Specdb::NmrOneD 26738 Specdb::NmrOneD 26739 Specdb::NmrOneD 26740 Specdb::NmrOneD 26741 HMDB38458 #<Reference:0x000055ce2ef5bcc8> Common mushroom Type 1 specific Agaricus bisporus 5341 Garden onion Type 1 specific Allium cepa 4679 Garden onion (var.) Type 1 specific Allium cepa var. cepa 4679 Green onion Type 1 Mushrooms Unknown generic Onion-family vegetables Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322 Red onion Type 1 Welsh onion Type 1 specific Allium fistulosum 35875