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L-L-Homoglutathione

PubChem CID: 3375152

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Compound Synonyms L-L-Homoglutathione, 2-amino-5-[[1-(2-carboxyethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid, H-GLU(CYS-BETA-ALA-OH)-OH, SCHEMBL4653672, CHEBI:187463, 2-amino-5-[[1-(2-carboxyethylamino)-1-oxo-3-sulanylpropan-2-yl]amino]-5-oxopentanoic acid
Topological Polar Surface Area 160.0
Hydrogen Bond Donor Count 6.0
Inchi Key HKBNQXMLSMKLJV-UHFFFAOYSA-N
Rotatable Bond Count 10.0
Synonyms g-Glutamylcysteinyl-b-alanine, N-[1-[(2-Carboxyethyl)carbamoyl]-2-mercaptoethyl]glutamine, 8CI
Heavy Atom Count 21.0
Compound Name L-L-Homoglutathione
Description L-l-homoglutathione is a member of the class of compounds known as hybrid peptides. Hybrid peptides are compounds containing at least two different types of amino acids (alpha, beta, gamma, delta) linked to each other through a peptide bond. L-l-homoglutathione is practically insoluble (in water) and a moderately acidic compound (based on its pKa). L-l-homoglutathione can be found in pulses, which makes L-l-homoglutathione a potential biomarker for the consumption of this food product.
Exact Mass 321.099
Formal Charge 0.0
Monoisotopic Mass 321.099
Isotope Atom Count 0.0
Molecular Complexity 403.0
Hydrogen Bond Acceptor Count 8.0
Molecular Weight 321.35
Database Name fooddb_chem_all;pubchem
Covalent Unit Count 1.0
Defined Atom Stereocenter Count 0.0
Iupac Name 2-amino-5-[[1-(2-carboxyethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid
Total Atom Stereocenter Count 2.0
Total Bond Stereocenter Count 0.0
Inchi InChI=1S/C11H19N3O6S/c12-6(11(19)20)1-2-8(15)14-7(5-21)10(18)13-4-3-9(16)17/h6-7,21H,1-5,12H2,(H,13,18)(H,14,15)(H,16,17)(H,19,20)
Smiles C(CC(=O)NC(CS)C(=O)NCCC(=O)O)C(C(=O)O)N
Xlogp -4.6
Defined Bond Stereocenter Count 0.0
Molecular Formula C11H19N3O6S

  • 1. Outgoing r'ship FOUND_IN to/from Vigna Radiata (Plant) Rel Props:Source_db:fooddb_chem_all