GPF

N-(phosphonomethyl)glycine

Created: 2008-12-17
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count18
Chiral Atom Count0
Bond Count17
Aromatic Bond Count0
2D diagram of GPF

Chemical Component Summary

NameN-(phosphonomethyl)glycine
Systematic Name (OpenEye OEToolkits)2-(phosphonomethylamino)ethanoic acid
FormulaC3 H8 N O5 P
Molecular Weight169.073
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C(O)CNCP(=O)(O)O
SMILESCACTVS3.341OC(=O)CNC[P](O)(O)=O
SMILESOpenEye OEToolkits1.5.0C(C(=O)O)NCP(=O)(O)O
Canonical SMILESCACTVS3.341 OC(=O)CNC[P](O)(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 C(C(=O)O)NCP(=O)(O)O
InChIInChI1.03 InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)
InChIKeyInChI1.03 XDDAORKBJWWYJS-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 59310676, 3496
ChEMBL CHEMBL95764
ChEBI CHEBI:27744