Record Information
Version1.0
Creation Date2016-05-19 01:58:19 UTC
Update Date2016-11-09 01:09:29 UTC
Accession NumberCHEM005121
Identification
Common NameCINNAMON BARK OLEORESIN, CEYLON, CHINESE, OR SAIGON (CINNAMOMUM SPP.)
ClassSmall Molecule
Description
Contaminant Sources
  • EAFUS Chemicals
  • HPV EPA Chemicals
  • IARC Carcinogens Group 3
Contaminant TypeNot Available
Chemical Structure
Thumb
Synonyms
ValueSource
Au(+)ChEBI
GOLD ionChEBI
Gold, ion(1+)ChEBI
Au gold powderHMDB
AurideHMDB
AurumHMDB
Aurum metallicumHMDB
Burnish goldHMDB
Gold colloidalHMDB
Gold elementalHMDB
Gold flakeHMDB
Gold leafHMDB
Gold(0)HMDB
Magnesium gold purpleHMDB
MyochrysineHMDB
Shell goldHMDB
Chemical FormulaAu
Average Molecular Mass196.967 g/mol
Monoisotopic Mass196.967 g/mol
CAS Registry Number977091-23-8
IUPAC Namegold(1+) ion
Traditional Namegold(1+) ion
SMILES[Au]
InChI IdentifierInChI=1S/Au
InChI KeyPCHJSUWPFVWCPO-UHFFFAOYSA-N
Chemical Taxonomy
Description 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.
KingdomInorganic compounds
Super ClassHomogeneous metal compounds
ClassHomogeneous transition metal compounds
Sub ClassNot Available
Direct ParentHomogeneous transition metal compounds
Alternative ParentsNot Available
Substituents
  • Homogeneous transition metal
Molecular FrameworkNot Available
External Descriptors
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
PathwaysNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted Properties
PropertyValueSource
logP0.03ChemAxon
Physiological Charge1ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area0 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity0 m³·mol⁻¹ChemAxon
Polarizability1.78 ųChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-0002-0900000000-d886ab3ee35928854b05Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-0002-0900000000-d886ab3ee35928854b05Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-0002-0900000000-d886ab3ee35928854b05Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-0002-0900000000-2613b750272dd2ffd73bSpectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-0002-0900000000-2613b750272dd2ffd73bSpectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-0002-0900000000-2613b750272dd2ffd73bSpectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-0002-0900000000-b94cc1be53acae74b786Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-0002-0900000000-b94cc1be53acae74b786Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-0002-0900000000-b94cc1be53acae74b786Spectrum
Toxicity Profile
Route of ExposureNot Available
Mechanism of ToxicityNot Available
MetabolismNot Available
Toxicity ValuesNot Available
Lethal DoseNot Available
Carcinogenicity (IARC Classification)Not Available
Uses/SourcesNot Available
Minimum Risk LevelNot Available
Health EffectsNot Available
SymptomsNot Available
TreatmentNot Available
Concentrations
Not Available
DrugBank IDNot Available
HMDB IDHMDB0004138
FooDB IDFDB016246
Phenol Explorer IDNot Available
KNApSAcK IDC00001466
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDAU
Wikipedia LinkGold
Chemspider ID102884
ChEBI ID49482
PubChem Compound ID114945
Kegg Compound IDNot Available
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General References
1. Eisler R: Mammalian sensitivity to elemental gold (Au degrees). Biol Trace Elem Res. 2004 Jul;100(1):1-18.
2. Moller H: Dental gold alloys and contact allergy. Contact Dermatitis. 2002 Aug;47(2):63-6.