Not Available
Record Information
Version1.0
Created at2020-11-02 22:38:57 UTC
Updated at2020-11-18 16:40:19 UTC
CannabisDB IDCDB006362
Secondary Accession NumbersNot Available
Cannabis Compound Identification
Common NameBarium
DescriptionBarium, also known as ba(2+) or barium ion, belongs to the class of inorganic compounds known as homogeneous alkaline earth metal compounds. These are inorganic compounds containing only metal atoms,with the largest atom being a alkaline earth metal atom. Based on a literature review a significant number of articles have been published on Barium.
Structure
Thumb
Synonyms
ValueSource
Ba(2+)ChEBI
Ba2+ChEBI
BARIUM ionChEBI
Barium(2+)Kegg
BaHMDB
BariumChEBI
Chemical FormulaBa
Average Molecular Weight137.327
Monoisotopic Molecular Weight137.905241273
IUPAC Namebarium(2+) ion
Traditional Namebarium(2+) ion
CAS Registry NumberNot Available
SMILES
[Ba++]
InChI Identifier
InChI=1S/Ba/q+2
InChI KeyXDFCIPNJCBUZJN-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of inorganic compounds known as homogeneous alkaline earth metal compounds. These are inorganic compounds containing only metal atoms,with the largest atom being a alkaline earth metal atom.
KingdomInorganic compounds
Super ClassHomogeneous metal compounds
ClassHomogeneous alkaline earth metal compounds
Sub ClassNot Available
Direct ParentHomogeneous alkaline earth metal compounds
Alternative ParentsNot Available
Substituents
  • Homogeneous alkaline earth metal
Molecular FrameworkNot Available
External Descriptors
Ontology
Not Available
Physical Properties
StateNot Available
Experimental Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
logPNot AvailableNot Available
Predicted Properties
PropertyValueSource
logP-0.2ChemAxon
Physiological Charge2ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area0 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity0 m³·mol⁻¹ChemAxon
Polarizability1.78 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Spectra
Pathways
Pathways
Protein Targets
EnzymesNot Available
TransportersNot Available
Metal BindingsNot Available
ReceptorsNot Available
Transcriptional FactorsNot Available
Concentrations Data
Cannabis CultivarStatusValueReferenceDetails
Alien DawgDetected and Quantified0.005 mg/g dry wt
    • David S. Wishart,...
details
GabriolaDetected and Quantified0.004 mg/g dry wt
    • David S. Wishart,...
details
Island HoneyDetected and Quantified0.007 mg/g dry wt
    • David S. Wishart,...
details
QuadraDetected and Quantified0.002 mg/g dry wt
    • David S. Wishart,...
details
Sensi StarDetected and Quantified0.001 mg/g dry wt
    • David S. Wishart,...
details
Tangerine DreamDetected and Quantified0.0 mg/g dry wt
    • David S. Wishart,...
details
HMDB IDHMDB0004142
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FoodDB IDFDB003764
KNApSAcK IDC00016417
Chemspider ID94609
KEGG Compound IDC13881
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkBarium
METLIN IDNot Available
PubChem Compound104810
PDB IDNot Available
ChEBI ID37136
References
General ReferencesNot Available