Showing metabocard for Palladium (BMDB0013670)

IdentificationTaxonomyPhysical propertiesSpectraConcentrationsLinksReferencesXML
Record Information
Version1.0
Creation Date2016-10-03 18:40:31 UTC
Update Date2020-06-04 19:38:48 UTC
MCDB ID BMDB0013670
Secondary Accession Numbers
  • BMDB13670
Metabolite Identification
Common NamePalladium
DescriptionPalladium, also known as 46PD or paladio, 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. Palladium exists as a solid, possibly soluble (in water), and possibly neutral molecule. Palladium is a potentially toxic compound.
Structure
Thumb
MOLSDFPDBSMILESInChI
Synonyms
ValueSource
46pdChEBI
PaladioChEBI
PdChEBI
Chemical FormulaPd
Average Molecular Weight106.42
Monoisotopic Molecular Weight105.903483087
IUPAC Namepalladium
Traditional Namepalladium
CAS Registry Number7440-05-3
SMILES
[Pd]
InChI Identifier
InChI=1S/Pd
InChI KeyKDLHZDBZIXYQEI-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
Physical Properties
StateSolid
Experimental Properties
PropertyValueReference
Melting Point1554.9 °CNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogP0.0Not Available
Predicted Properties
PropertyValueSource
logP0ChemAxon
Physiological Charge0ChemAxon
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
Spectrum TypeDescriptionSplash KeyDeposition DateView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-0a4i-0900000000-cfbea5880bde44122df52016-06-03View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-0a4i-0900000000-cfbea5880bde44122df52016-06-03View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-0a4i-0900000000-cfbea5880bde44122df52016-06-03View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-0udi-0900000000-e5a383c648e39dd19c112016-08-03View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-0udi-0900000000-e5a383c648e39dd19c112016-08-03View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-0udi-0900000000-e5a383c648e39dd19c112016-08-03View Spectrum
Concentrations
StatusValueReferenceDetails
Detected and Quantified1.3 +/- 0.1 uM details
Detected and Quantified2 +/- 1 uM details
Detected and Quantified2 +/- 1 uM details
Detected and Quantified1.0 +/- 0.2 uM details
Detected and Quantified0.00132 - 0.413 uM details
HMDB IDHMDB0013670
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FoodDB IDFDB030040
KNApSAcK IDNot Available
Chemspider ID22380
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkPalladium
METLIN IDNot Available
PubChem Compound23938
PDB IDNot Available
ChEBI ID33363
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Download (PDF)
General References
  1. Hermansen JE, Badsberg JH, Kristensen T, Gundersen V: Major and trace elements in organically or conventionally produced milk. J Dairy Res. 2005 Aug;72(3):362-8. doi: 10.1017/S0022029905000968. [PubMed:16174368 ]
  2. A. Foroutan et al. (2019). A. Foroutan et al. The Chemical Composition of Commercial Cow's Milk (in preparation). Journal of Agricultural and Food Chemistry.