2-(phosphonomethyl)pentanedioic acid

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 16
Total Number of Articles : 65
PubChem 10130754
Molecular Formula

C6H11O7P

SMILES

C(CC(=O)O)C(CP(=O)(O)O)C(=O)O

InChI

InChI=1S/C6H11O7P/c7-5(8)2-1-4(6(9)10)3-14(11,12)13/h4H,1-3H2,(H,7,8)(H,9,10)(H2,11,12,13)

synonyms
  • 2-(phosphonomethyl)pentanedioic acid
  • 2-PMPA
  • DTXSID90436036
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Properties
Property Value
MW 226.12 g/mol
HBD 4
HBA 7
Rotatable Bond Count 6
Exact Mass 226.02423968 g/mol
Monoisotopic Mass 226.02423968 g/mol
Heavy Atom Count 14
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 267
xlogp -2.2
Topological Polar Surface Area 132