Record Information
Version1.0
Creation Date2016-09-30 22:53:42 UTC
Update Date2020-06-04 19:27:15 UTC
BMDB IDBMDB0002290
Secondary Accession Numbers
  • BMDB02290
Metabolite Identification
Common NameArsenic
DescriptionArsenic, also known as arsen or as(3+), belongs to the class of inorganic compounds known as homogeneous metalloid compounds. These are inorganic compounds containing only metal atoms,with the largest atom being a metalloid atom. Arsenic exists as a solid, possibly soluble (in water), and possibly neutral molecule. Arsenic is formally rated as a carcinogen (by IARC 1) and is also a potentially toxic compound.
Structure
Thumb
Synonyms
ValueSource
As(3+)ChEBI
ArsenHMDB
Arsenic blackHMDB
Arsenic elementalHMDB
AsHMDB
Grey arsenicHMDB
Metallic arsenicHMDB
Chemical FormulaAs
Average Molecular Weight74.9216
Monoisotopic Molecular Weight74.921596417
IUPAC Namearsenic(3+) ion
Traditional Namearsenic(3+) ion
CAS Registry Number7440-38-2
SMILES
[As+3]
InChI Identifier
InChI=1S/As/q+3
InChI KeyLULLIKNODDLMDQ-UHFFFAOYSA-N
Chemical Taxonomy
Description belongs to the class of inorganic compounds known as homogeneous metalloid compounds. These are inorganic compounds containing only metal atoms,with the largest atom being a metalloid atom.
KingdomInorganic compounds
Super ClassHomogeneous metal compounds
ClassHomogeneous metalloid compounds
Sub ClassNot Available
Direct ParentHomogeneous metalloid compounds
Alternative ParentsNot Available
Substituents
  • Homogeneous metalloid
Molecular FrameworkNot Available
External Descriptors
Ontology
StatusDetected and Quantified
Origin
  • Endogenous
BiofunctionNot Available
ApplicationNot Available
Cellular locationsNot Available
Physical Properties
StateSolid
Experimental Properties
PropertyValueReference
Melting Point> 615 °CNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Predicted Properties
PropertyValueSource
logP0.75ChemAxon
Physiological Charge3ChemAxon
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 FilterYesChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleYesChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash Key
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-001i-9000000000-6183cd0482f342082392View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-001i-9000000000-6183cd0482f342082392View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-001i-9000000000-6183cd0482f342082392View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-004i-9000000000-30fac8ea879bd5e34966View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-004i-9000000000-30fac8ea879bd5e34966View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-004i-9000000000-30fac8ea879bd5e34966View in MoNA
Biological Properties
Cellular LocationsNot Available
Biospecimen Locations
  • Milk
Pathways
Normal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
MilkDetected and Quantified0.387 - 0.467 uMNot SpecifiedNot SpecifiedNormal
    • Z. Dobrzański, R....
details
MilkDetected and Quantified0.11 - 0.18 uMNot SpecifiedNot SpecifiedNormal
    • Tanmoy Rana et al...
details
MilkDetected and Quantified0.13 +/- 0.01 uMNot SpecifiedNot Specified
Normal
details
MilkDetected and Quantified0.14 +/- 0.01 uMNot SpecifiedNot Specified
Normal
details
MilkDetected and Quantified0.14 +/- 0.01 uMNot SpecifiedNot Specified
Normal
details
MilkDetected and Quantified0.11 +/- 0.05 uMNot SpecifiedNot Specified
Normal
details
MilkDetected and Quantified0.0525 +/- 0.000801 uMNot SpecifiedNot Specified
Normal
    • Patricia Cava-Mon...
details
MilkDetected and Quantified0.0547 +/- 0.00133 uMNot SpecifiedNot Specified
Normal
    • Patricia Cava-Mon...
details
MilkDetected and Quantified0.0575 +/- 0.00120 uMNot SpecifiedNot Specified
Normal
    • Patricia Cava-Mon...
details
MilkDetected and Quantified0.0467 +/- 0.00133 uMNot SpecifiedNot Specified
Normal
    • Patricia Cava-Mon...
details
MilkDetected and Quantified0.0280 +/- 0.00133 uMNot SpecifiedNot Specified
Normal
    • Patricia Cava-Mon...
details
MilkDetected and Quantified0.0440 +/- 0.00267 uMNot SpecifiedNot Specified
Normal
    • Patricia Cava-Mon...
details
Abnormal Concentrations
Not Available
HMDB IDHMDB0002290
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB003763
KNApSAcK IDNot Available
Chemspider ID94549
KEGG Compound IDC06269
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkArsenic
METLIN IDNot Available
PubChem Compound104734
PDB IDNot Available
ChEBI ID35828
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. T Rana, S Sarkar, T Mandal, K Bhattacharyya, A Roy, L Kol (2017). Tanmoy Rana et al. Contribution of arsenic from agricultural food chain to cow milk in highly arsenic prone zone in Nadia District of West Bengal in India.The Internet Journal of Veterinary Medicine Vol 4(2). The Internet Journal of Veterinary Medicine .
  2. 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.
  3. 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.
  4. 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.

Enzymes

General function:
Inorganic ion transport and metabolism
Specific function:
ATPase required for the post-translational delivery of tail-anchored (TA) proteins to the endoplasmic reticulum. Recognizes and selectively binds the transmembrane domain of TA proteins in the cytosol. This complex then targets to the endoplasmic reticulum by membrane-bound receptors, where the tail-anchored protein is released for insertion. This process is regulated by ATP binding and hydrolysis. ATP binding drives the homodimer towards the closed dimer state, facilitating recognition of newly synthesized TA membrane proteins. ATP hydrolysis is required for insertion. Subsequently, the homodimer reverts towards the open dimer state, lowering its affinity for the membrane-bound receptor, and returning it to the cytosol to initiate a new round of targeting.
Gene Name:
GET3
Uniprot ID:
A5PJI5
Molecular weight:
38793.0