Showing metabocard for Zinc (BMDB0001303)

IdentificationTaxonomyPhysical propertiesSpectraConcentrationsLinksReferencesXML
Record Information
Version1.0
Creation Date2016-09-30 22:43:51 UTC
Update Date2020-06-04 20:49:58 UTC
MCDB ID BMDB0001303
Secondary Accession Numbers
  • BMDB01303
Metabolite Identification
Common NameZinc
DescriptionZinc, also known as ZN2+ or zinc ion, 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. Zinc is possibly soluble (in water) and possibly neutral. Zinc exists in all living species, ranging from bacteria to humans. Zinc is a potentially toxic compound.
Structure
Thumb
MOLSDFPDBSMILESInChI
Synonyms
ValueSource
Dietary zincChEBI
Zinc cationChEBI
ZINC ionChEBI
Zinc, ion (ZN2+)ChEBI
ZN(II)ChEBI
ZN(2+)ChEBI
ZN2+ChEBI
Mannosidase b, alphaMeSH
alpha Mannosidase bMeSH
alpha-D-Mannoside mannohydrolaseMeSH
Neutral alpha-mannosidaseMeSH
alpha D MannosidaseMeSH
alpha-D-MannosidaseMeSH
Lysosomal alpha-mannosidaseMeSH
Mannohydrolase, alpha-D-mannosideMeSH
alpha MannosidaseMeSH
alpha-MannosidaseMeSH
LAMANMeSH
Lysosomal alpha mannosidaseMeSH
Neutral alpha mannosidaseMeSH
alpha D Mannoside mannohydrolaseMeSH
alpha-Mannosidase, lysosomalMeSH
alpha-Mannosidase, neutralMeSH
Topostin bMeSH
Chemical FormulaZn
Average Molecular Weight65.409
Monoisotopic Molecular Weight63.929146578
IUPAC Namezinc(2+) ion
Traditional Namezinc(2+) ion
CAS Registry Number7440-66-6
SMILES
[Zn++]
InChI Identifier
InChI=1S/Zn/q+2
InChI KeyPTFCDOFLOPIGGS-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 PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Predicted Properties
PropertyValueSource
logP0.16ChemAxon
pKa (Strongest Acidic)3.09ChemAxon
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
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, Positivesplash10-03di-9000000000-0cd08967c771fb6453292015-09-15View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-03di-9000000000-0cd08967c771fb6453292015-09-15View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-03di-9000000000-0cd08967c771fb6453292015-09-15View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-03di-9000000000-29976d3ebd17b2d11a4b2015-09-15View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-03di-9000000000-29976d3ebd17b2d11a4b2015-09-15View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-03di-9000000000-29976d3ebd17b2d11a4b2015-09-15View Spectrum
Concentrations
StatusValueReferenceDetails
Detected and Quantified70 +/- 16 uM details
Detected and Quantified46 +/- 3.1 uM details
Detected and Quantified55 uM details
Detected and Quantified55 uM details
Detected and Quantified64 uM details
Detected and Quantified61 uM details
Detected and Quantified58 uM details
Detected and Quantified69 uM details
Detected and Quantified61 uM details
Detected and Quantified64 uM details
Detected and Quantified69 uM details
Detected and Quantified63 uM details
Detected and Quantified64 uM details
Detected and Quantified64 uM details
Detected and Quantified63 uM details
Detected and Quantified63 uM details
Detected and Quantified58 uM details
Detected and Quantified69 uM details
Detected and Quantified61 uM details
Detected and Quantified63 uM details
Detected and Quantified73 uM details
Detected and Quantified73 uM details
Detected and Quantified63 uM details
Detected and Quantified63 uM details
Detected and Quantified63 uM details
Detected and Quantified57 uM details
Detected and Quantified57 uM details
Detected and Quantified72 uM details
Detected and Quantified64 uM details
Detected and Quantified64 uM details
Detected and Quantified81 uM
  • Park, Y. W; Juáre...
 details
Detected and Quantified54 +/- 8 uM details
Detected and Quantified65 +/- 5 uM details
Detected and Quantified69 +/- 6 uM details
Detected and Quantified65 +/- 3 uM details
Detected and Quantified61 uM details
Detected and Quantified46 - 61 uM details
Detected and Quantified7.34 - 50 uM
  • Semaghiul Birghil...
 details
Detected and Quantified47 - 48 uM
  • Z. Dobrzański, R....
 details
Detected and Quantified44 +/- 1.911 uM
  • Patricia Cava-Mon...
 details
Detected and Quantified21 +/- 2 uM
  • Patricia Cava-Mon...
 details
Detected and Quantified50 +/- 3.134 uM
  • Patricia Cava-Mon...
 details
Detected and Quantified19 +/- 1.162 uM
  • Patricia Cava-Mon...
 details
Detected and Quantified21 +/- 1.2 uM
  • Patricia Cava-Mon...
 details
Detected and Quantified16 +/- 2.92 uM
  • Patricia Cava-Mon...
 details
HMDB IDHMDB0001303
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FoodDB IDFDB031256
KNApSAcK IDNot Available
Chemspider IDNot Available
KEGG Compound IDC00038
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound32051
PDB IDNot Available
ChEBI ID29105
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Download (PDF)
General References
  1. Zhang P, Allen JC: A novel dialysis procedure measuring free Zn2+ in bovine milk and plasma. J Nutr. 1995 Jul;125(7):1904-10. doi: 10.1093/jn/125.7.1904. [PubMed:7616307 ]
  2. Campillo N, Vinas P, Lopez-Garcia I, Hernandez-Cordoba M: Direct determination of copper and zinc in cow milk, human milk and infant formula samples using electrothermal atomization atomic absorption spectrometry. Talanta. 1998 Aug;46(4):615-22. [PubMed:18967184 ]
  3. Gaucheron F: Milk and dairy products: a unique micronutrient combination. J Am Coll Nutr. 2011 Oct;30(5 Suppl 1):400S-9S. [PubMed:22081685 ]
  4. Semaghiul Birghila, Simona Dobrinas, Gabriela Stanciu and Alina Soceanu (2008). Semaghiul Birghila, Simona Dobrinas, Gabriela Stanciu and Alina Soceanu. Determination of major and minor elements in milk through ICP-AES. Environmental Engineering and Management Journal. November/December 2008, Vol.7, No.6, 805-808. Environmental Engineering and Management Journal.
  5. Z. Dobrzański, R. Kołacz, H. Górecka, K. Chojnacka, A. Bartkowiak. (2005). Z. Dobrzański, R. Kołacz, H. Górecka, K. Chojnacka, A. Bartkowiak. 2005. The Content of Microelements and Trace Elements in Raw Milk from Cows in the Silesian Region. Pol. J. Environ. Stud. 14(5):685–689. Polish Journal of Environmental Studies.
  6. Park, Y. W; Juárez, Manuela ; Ramos, M.; Haenlein, G. F. W. (2007). Park, Y. W; Juárez, Manuela ; Ramos, M.; Haenlein, G. F. W.. Physico-chemical characteristics of goat and sheep milk. Small Ruminant Res.(2007) 68:88-113 doi: 10.1016/j.smallrumres.2006.09.013. Small Ruminant Research.
  7. 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.
  8. Patricia Cava-Montesinos, M. Luisa Cervera Agustín Pastor Miguel de la Guardia (2005). Patricia Cava-Montesinos, M. Luisa Cervera Agustín Pastor Miguel de la Guardia. 2005. Room temperature acid sonication ICP-MS multielemental analysis of milk.Analytica Chimica Acta Volume 531, Issue 1, Pages 111-123. Analytica Chimica Acta.
  9. USDA Food Composition Databases [Link]
  10. Fooddata+, The Technical University of Denmark (DTU) [Link]