Record Information
Version 1.0
Update Date 1/22/2018 11:54:53 AM
Metabolite IDPAMDB001790
Identification
Name: Fe3+
Description:The major activity of supplemental iron is in the prevention and treatment of iron deficiency anemia. Iron has putative immune-enhancing, anticarcinogenic and cognition-enhancing activities.
Structure
Thumb
Synonyms:
  • FE (III) ION
  • Fe(3+)
  • Fe(III)
  • Ferric ion
  • Iron(3+)
  • Iron(III) ion
  • Iron, ion (Fe(3+))
Chemical Formula: Fe
Average Molecular Weight: 55.845
Monoisotopic Molecular Weight: 55.934942133
InChI Key: VTLYFUHAOXGGBS-UHFFFAOYSA-N
InChI:InChI=1S/Fe/q+3
CAS number: 7439-89-6
IUPAC Name:iron(3+) ion
Traditional IUPAC Name: iron(3+) ion
SMILES:[Fe+3]
Chemical Taxonomy
Taxonomy DescriptionThis compound belongs to the class of inorganic compounds known as homogeneous transition metal compounds. These are inorganic compounds containing only metal atoms,with the largest atom being a transition metal atom.
Kingdom Inorganic compounds
Super ClassHomogeneous metal compounds
Class Homogeneous transition metal compounds
Sub ClassNot Available
Direct Parent Homogeneous transition metal compounds
Alternative Parents Not Available
Substituents
  • Homogeneous transition metal
  • Acyclic compound
Molecular Framework Acyclic compounds
External Descriptors
Physical Properties
State: Solid
Charge:3
Melting point: Not Available
Experimental Properties:
PropertyValueSource
Predicted Properties
PropertyValueSource
logP-0.77ChemAxon
Physiological Charge3ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area0 Å2ChemAxon
Rotatable Bond Count0ChemAxon
Refractivity0 m3·mol-1ChemAxon
Polarizability1.78 Å3ChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleYesChemAxon
Biological Properties
Cellular Locations: Cytoplasm
Reactions:
Pathways:
Spectra
Spectra:
Spectrum TypeDescriptionSplash Key
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-0a4i-9000000000-af3e7aec4f5bd9668683View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-0a4i-9000000000-af3e7aec4f5bd9668683View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-0a4i-9000000000-af3e7aec4f5bd9668683View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-0udi-9000000000-3335fec4c3184739b75eView in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-0udi-9000000000-3335fec4c3184739b75eView in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-0udi-9000000000-3335fec4c3184739b75eView in MoNA
References
References: Not Available
Synthesis Reference: Not Available
Material Safety Data Sheet (MSDS) Not Available
External Links:
ResourceLink
CHEBI ID29034
HMDB IDHMDB12943
Pubchem Compound ID23925
Kegg IDC14819
ChemSpider ID27815
WikipediaNULL
BioCyc IDFE%2b3
EcoCyc IDFE%2b3
Ligand ExpoFE

Enzymes

General function:
Not Available
Specific function:
Not Available
Gene Name:
ftnA
Locus Tag:
PA4235
Molecular weight:
17.9 kDa
General function:
Inorganic ion transport and metabolism
Specific function:
May perform analogous functions in iron detoxification and storage to that of animal ferritins
Gene Name:
bfr
Locus Tag:
PA3531
Molecular weight:
18.6 kDa
Reactions
4 Fe(2+) + 4 H(+) + O(2) = 4 Fe(3+) + 2 H(2)O.

Transporters