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Showing NP-Card for Rhenium (NP0049986)

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Record Information
Version2.0
Created at2022-03-17 21:21:21 UTC
Updated at2022-03-17 21:21:21 UTC
NP-MRD IDNP0049986
Secondary Accession NumbersNone
Natural Product Identification
Common NameRhenium
DescriptionRhenium, also known as 75RE or renio, 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. Rhenium is possibly neutral. Outside of the human body, Rhenium is found, on average, in the highest concentration within a few different foods, such as milk (cow), dills, and romaine lettuces and in a lower concentration in sunburst squash (pattypan squash), green zucchinis, and yellow zucchinis. This could make rhenium a potential biomarker for the consumption of these foods. It can be prepared by many routes, a typical method is the reaction of Re2O7 and tetramethyltin:; Rhenium is a chemical element with the symbol Rhenium and atomic number 75. Naturally occurring rhenium is 37.4% 185Re, which is stable, and 62.6% 187Re, which is unstable but has a very long half-life (~1010 years). Worldwide, 30% of catalysts used for this process contain rhenium. Rhenium is probably not found free in natuRhenium (its possible natural occurrence is uncertain), but occurs in amounts up to 0.2% In the mineral molybdenite (which is primarily molybdenum disulfide), the major commercial source, although single molybdenite samples with up to 1.88% Have been found.
Structure
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MOLSDFPDBSMILESInChI

MOL for NP0049986 (Rhenium)


  Mrv0541 02271201192D          

  1  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Re  0  0  0  0  0  0  0  0  0  0  0  0
M  END
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3D MOL for NP0049986 (Rhenium)

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3D SDF for NP0049986 (Rhenium)

  Mrv0541 02271201192D          

  1  0  0  0  0  0            999 V2000
    0.0000    0.0000    0.0000 Re  0  0  0  0  0  0  0  0  0  0  0  0
M  END
> <DATABASE_ID>
NP0049986

> <DATABASE_NAME>
NP-MRD

> <SMILES>
[Re]

> <INCHI_IDENTIFIER>
InChI=1S/Re

> <INCHI_KEY>
WUAPFZMCVAUBPE-UHFFFAOYSA-N

> <FORMULA>
Re

> <MOLECULAR_WEIGHT>
186.207

> <EXACT_MASS>
186.955750787

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
1.7784

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
rhenium

> <JCHEM_LOGP>
0

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
0

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
rhenium

> <JCHEM_VEBER_RULE>
1

$$$$

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3D-SDF for NP0049986 (Rhenium)
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PDB for NP0049986 (Rhenium)
HEADER    PROTEIN                                 27-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   27-FEB-12         0                                  
HETATM    1 Re   UNK     0       0.000   0.000   0.000  0.00  0.00          Re+0
MASTER        0    0    0    0    0    0    0    0    1    0    0    0
END

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3D PDB for NP0049986 (Rhenium)
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SMILES for NP0049986 (Rhenium)
[Re]
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INCHI for NP0049986 (Rhenium)
InChI=1S/Re
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View in JSmol
Synonyms
ValueSource
75ReChEBI
ReChEBI
RenioChEBI
RheniumChEBI
Chemical FormulaRe
Average Mass186.2070 Da
Monoisotopic Mass186.95575 Da
IUPAC Namerhenium
Traditional Namerhenium
CAS Registry Number7440-15-5
SMILES
[Re]
InChI Identifier
InChI=1S/Re
InChI KeyWUAPFZMCVAUBPE-UHFFFAOYSA-N
Experimental Spectra
Not Available
Predicted Spectra
Not Available
Chemical Shift Submissions
Not Available
Species
Species of Origin
Species NameSourceReference
Anas platyrhynchosFooDB
AnatidaeFooDB
Anser anserFooDB
Bison bisonFooDB
Bos taurusFooDB
Bos taurus X Bison bisonFooDB
Bubalus bubalisFooDB
Capra aegagrus hircusFooDB
CervidaeFooDB
Cervus canadensisFooDB
ColumbaFooDB
ColumbidaeFooDB
Dromaius novaehollandiaeFooDB
Equus caballusFooDB
Gallus gallusFooDB
Lagopus mutaFooDB
LeporidaeFooDB
Lepus timidusFooDB
Melanitta fuscaFooDB
Meleagris gallopavoFooDB
Numida meleagrisFooDB
OdocoileusFooDB
OryctolagusFooDB
Ovis ariesFooDB
PhasianidaeFooDB
Phasianus colchicusFooDB
Struthio camelusFooDB
Sus scrofaFooDB
Sus scrofa domesticaFooDB
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 IDHMDB0013719  
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FoodDB IDFDB030065  
KNApSAcK IDNot Available
Chemspider ID22388  
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkRhenium  
METLIN IDNot Available
PubChem Compound23947  
PDB IDRE  
ChEBI ID49882  
Good Scents IDNot Available
References
General ReferencesNot Available