Np mrd loader

Showing NP-Card for Tungsten (NP0046255)

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Record Information
Version2.0
Created at2022-03-17 19:55:05 UTC
Updated at2022-03-17 19:55:05 UTC
NP-MRD IDNP0046255
Secondary Accession NumbersNone
Natural Product Identification
Common NameTungsten
DescriptionNot Available
Structure
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MOLSDFPDBSMILESInChI

MOL for NP0046255 (Tungsten)


  Mrv1652305221920092D          

  1  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 W   0  0  0  0  0  0  0  0  0  0  0  0
M  END
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3D MOL for NP0046255 (Tungsten)

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3D SDF for NP0046255 (Tungsten)

  Mrv1652305221920092D          

  1  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 W   0  0  0  0  0  0  0  0  0  0  0  0
M  END
> <DATABASE_ID>
NP0046255

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[W]

> <INCHI_IDENTIFIER>
InChI=1S/W

> <INCHI_KEY>
WFKWXMTUELFFGS-UHFFFAOYSA-N

> <FORMULA>
W

> <MOLECULAR_WEIGHT>
183.84

> <EXACT_MASS>
183.950932553

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
1

> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
tungsten

> <JCHEM_LOGP>
0.0

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
0.0

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
tungsten

> <JCHEM_VEBER_RULE>
1

$$$$

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3D-SDF for NP0046255 (Tungsten)
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PDB for NP0046255 (Tungsten)
HEADER    PROTEIN                                 22-MAY-19   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   22-MAY-19         0                                  
HETATM    1  W   UNK     0       0.000   0.000   0.000  0.00  0.00           W+0
MASTER        0    0    0    0    0    0    0    0    1    0    0    0
END

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3D PDB for NP0046255 (Tungsten)
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SMILES for NP0046255 (Tungsten)
[W]
Download
INCHI for NP0046255 (Tungsten)
InChI=1S/W
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View in JSmol
Synonyms
ValueSource
74WChEBI
Tungsten atomChEBI
TungsteneChEBI
TungstenoChEBI
VolframioChEBI
WChEBI
WolframChEBI
WolframioChEBI
WolframiumChEBI
Chemical FormulaW
Average Mass183.8400 Da
Monoisotopic Mass183.95093 Da
IUPAC Nametungsten
Traditional Nametungsten
CAS Registry Number7440-33-7
SMILES
[W]
InChI Identifier
InChI=1S/W
InChI KeyWFKWXMTUELFFGS-UHFFFAOYSA-N
Experimental Spectra
Not Available
Predicted Spectra
Not Available
Chemical Shift Submissions
Not Available
Species
Species of Origin
Species NameSourceReference
Anacardium occidentaleFooDB
Bertholletia excelsaFooDB
Cocos nuciferaFooDB
Corylus avellanaFooDB
Juglans cinereaFooDB
Juglans nigra L.FooDB
Pistacia veraFooDB
Prunus dulcisFooDB
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
StateNot Available
Experimental Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot 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
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
HMDB IDNot Available
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FoodDB IDFDB003790  
KNApSAcK IDNot Available
Chemspider IDNot Available
KEGG Compound IDC00753  
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkTungsten  
METLIN IDNot Available
PubChem Compound23964  
PDB IDNot Available
ChEBI ID27998  
Good Scents IDNot Available
References
General ReferencesNot Available