CGA

CARBOXYMETHYLATED GLUTAMIC ACID

Created: 1999-07-08
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count25
Chiral Atom Count1
Bond Count24
Aromatic Bond Count0
2D diagram of CGA

Chemical Component Summary

NameCARBOXYMETHYLATED GLUTAMIC ACID
Systematic Name (OpenEye OEToolkits)2-azanyl-5-(2-hydroxy-2-oxoethyloxy)-5-oxidanylidene-pentanoic acid
FormulaC7 H11 N O6
Molecular Weight205.165
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=C(O)COC(=O)CCC(C(=O)O)N
SMILESCACTVS3.370NC(CCC(=O)OCC(O)=O)C(O)=O
SMILESOpenEye OEToolkits1.7.6C(CC(=O)OCC(=O)O)C(C(=O)O)N
Canonical SMILESCACTVS3.370 NC(CCC(=O)OCC(O)=O)C(O)=O
Canonical SMILESOpenEye OEToolkits1.7.6 C(CC(=O)OCC(=O)O)C(C(=O)O)N
InChIInChI1.03 InChI=1S/C7H11NO6/c8-4(7(12)13)1-2-6(11)14-3-5(9)10/h4H,1-3,8H2,(H,9,10)(H,12,13)
InChIKeyInChI1.03 ICGBNHCVKQCJHW-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 52941768