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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 19:45:35 UTC
Update Date2022-03-07 02:54:14 UTC
HMDB IDHMDB0034831
Secondary Accession Numbers
  • HMDB34831
Metabolite Identification
Common NameOrthoperiodic acid
DescriptionOrthoperiodic acid, also known as [io(OH)5] or H5IO6, belongs to the class of inorganic compounds known as halogen oxides. These are inorganic compounds containing an oxygen atom of an oxidation state of -2, in which the heaviest atom bonded to the oxygen is a halogen. Orthoperiodic acid has been detected, but not quantified in, milk and milk products. This could make orthoperiodic acid a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Orthoperiodic acid.
Structure
Data?1563862621
Synonyms
ValueSource
[IO(OH)5]ChEBI
H5IO6ChEBI
OrthoperiodateGenerator
Hexaoxoiodic(5-) acidHMDB
Paraperiodic acidHMDB
Pentahydrogen hexaoxoiodate(5-)HMDB
PentahydroxidooxidoiodineHMDB
Pentahydroxy-lambda(7)-iodanoneHMDB
Periodic acidHMDB
Periodic acid (H5io6)HMDB
Periodic acid, crystHMDB
Acids, periodicMeSH
Periodic acid (hio4)MeSH
Acid, paraperiodicMeSH
Acid, periodicMeSH
Periodic acidsMeSH
Chemical FormulaH5IO6
Average Molecular Weight227.9406
Monoisotopic Molecular Weight227.913081312
IUPAC Nametetrahydroxyiodous acid
Traditional Nametetrahydroxyiodous acid
CAS Registry Number10450-60-9
SMILES
O[I](O)(O)(O)(O)=O
InChI Identifier
InChI=1S/H5IO6/c2-1(3,4,5,6)7/h(H5,2,3,4,5,6,7)
InChI KeyTWLXDPFBEPBAQB-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of inorganic compounds known as halogen oxides. These are inorganic compounds containing an oxygen atom of an oxidation state of -2, in which the heaviest atom bonded to the oxygen is a halogen.
KingdomInorganic compounds
Super ClassHomogeneous non-metal compounds
ClassHalogen organides
Sub ClassHalogen oxides
Direct ParentHalogen oxides
Alternative Parents
Substituents
  • Halogen oxide
  • Inorganic oxide
Molecular FrameworkNot Available
External Descriptors
Ontology
Not AvailableNot Available
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point130 °CNot Available
Boiling PointNot AvailableNot Available
Water Solubility1000000 mg/L @ 25 °C (est)The Good Scents Company Information System
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
logP-0.58ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count6ChemAxon
Hydrogen Donor Count5ChemAxon
Polar Surface Area118.22 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity27.61 m³·mol⁻¹ChemAxon
Polarizability13.13 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+120.27230932474
DeepCCS[M-H]-117.22630932474
DeepCCS[M-2H]-154.13930932474
DeepCCS[M+Na]+128.86530932474
AllCCS[M+H]+134.632859911
AllCCS[M+H-H2O]+131.232859911
AllCCS[M+NH4]+137.732859911
AllCCS[M+Na]+138.632859911
AllCCS[M-H]-146.532859911
AllCCS[M+Na-2H]-150.332859911
AllCCS[M+HCOO]-154.432859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Orthoperiodic acidO[I](O)(O)(O)(O)=O3743.6Standard polar33892256
Orthoperiodic acidO[I](O)(O)(O)(O)=O1104.5Standard non polar33892256
Orthoperiodic acidO[I](O)(O)(O)(O)=O1310.4Semi standard non polar33892256
Spectra
Biological Properties
Cellular LocationsNot Available
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB013395
KNApSAcK IDNot Available
Chemspider ID23622
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkPeriodic acid
METLIN IDNot Available
PubChem Compound25289
PDB IDNot Available
ChEBI ID29150
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDrw1273211
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .