Gamma-Carboxy-Glutamic Acid

Status : experimental

Chemical Classification

This compound 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.

L-alpha-amino acids

Organic compounds

Organic acids and derivatives

Carboxylic acids and derivatives

Amino acids, peptides, and analogues

Calculated Property

kind Value Source
logP -3 ALOGPS
logS -0.93 ALOGPS
Water Solubility 2.25e+01 g/l ALOGPS
logP -3.6 ChemAxon
IUPAC Name (1S)-1-aminopropane-1,3,3-tricarboxylic acid ChemAxon
Traditional IUPAC Name Gla ChemAxon
Molecular Weight 191.1388 ChemAxon
Monoisotopic Weight 191.042987025 ChemAxon
SMILES N[C@@H](CC(C(O)=O)C(O)=O)C(O)=O ChemAxon
Molecular Formula C6H9NO6 ChemAxon
InChI InChI=1S/C6H9NO6/c7-3(6(12)13)1-2(4(8)9)5(10)11/h2-3H,1,7H2,(H,8,9)(H,10,11)(H,12,13)/t3-/m0/s1 ChemAxon
InChIKey InChIKey=UHBYWPGGCSDKFX-VKHMYHEASA-N ChemAxon
Polar Surface Area (PSA) 137.92 ChemAxon
Refractivity 37.58 ChemAxon
Polarizability 16.25 ChemAxon
Rotatable Bond Count 5 ChemAxon
H Bond Acceptor Count 7 ChemAxon
H Bond Donor Count 4 ChemAxon
pKa (strongest acidic) 1.48 ChemAxon
pKa (strongest basic) 9.54 ChemAxon
Physiological Charge -2 ChemAxon
Number of Rings 0 ChemAxon
Bioavailability 1 ChemAxon
Rule of Five 1 ChemAxon
Ghose Filter 0 ChemAxon
MDDR-Like Rule 0 ChemAxon

Target within organism

  • Prothrombin : in Human
  • Osteocalcin : in Human
  • Coagulation factor X : in Human