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Quantitative metabolomics services for biomarker discovery and validation.
Specializing in ready to use metabolomics kits.
Your source for quantitative metabolomics technologies and bioinformatics.
Chromium compounds (CHEM008888)
Identification
Taxonomy
Biological Properties
Physical Properties
Toxicity Profile
Spectra
Concentrations
Links
References
XML
Record Information
Version
1.0
Creation Date
2016-05-19 02:54:24 UTC
Update Date
2016-11-09 01:13:53 UTC
Accession Number
CHEM008888
Identification
Common Name
Chromium compounds
Class
Small Molecule
Description
Contaminant Sources
HPV EPA Chemicals
Contaminant Type
Not Available
Chemical Structure
MOL
SDF
PDB
SMILES
InChI
×
Structure for CHEM008888: Chromium compounds
Synonyms
Value
Source
Chromic ion
ChEBI
Chromium (III) ion
ChEBI
CHROMIUM ion
ChEBI
Chromium(III)
ChEBI
CR(3+)
ChEBI
Chrome
HMDB
Chromium metal
HMDB
Cr
HMDB
Chemical Formula
Cr
Average Molecular Mass
51.996 g/mol
Monoisotopic Mass
51.941 g/mol
CAS Registry Number
E649962
IUPAC Name
chromium(3+) ion
Traditional Name
chromium(3+) ion
SMILES
[Cr]
InChI Identifier
InChI=1S/Cr
InChI Key
VYZAMTAEIAYCRO-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.
Kingdom
Inorganic compounds
Super Class
Homogeneous metal compounds
Class
Homogeneous transition metal compounds
Sub Class
Not Available
Direct Parent
Homogeneous transition metal compounds
Alternative Parents
Not Available
Substituents
Homogeneous transition metal
Molecular Framework
Not Available
External Descriptors
chromium cation (
CHEBI:49544
)
monoatomic trication (
CHEBI:49544
)
a cation (
CR+3
)
Biological Properties
Status
Detected and Not Quantified
Origin
Not Available
Cellular Locations
Not Available
Biofluid Locations
Not Available
Tissue Locations
Not Available
Pathways
Not Available
Applications
Not Available
Biological Roles
Not Available
Chemical Roles
Not Available
Physical Properties
State
Not Available
Appearance
Not Available
Experimental Properties
Property
Value
Melting Point
Not Available
Boiling Point
Not Available
Solubility
Not Available
Predicted Properties
Property
Value
Source
logP
-0.16
ChemAxon
pKa (Strongest Acidic)
3.09
ChemAxon
Physiological Charge
3
ChemAxon
Hydrogen Acceptor Count
0
ChemAxon
Hydrogen Donor Count
0
ChemAxon
Polar Surface Area
0 Ų
ChemAxon
Rotatable Bond Count
0
ChemAxon
Refractivity
0 m³·mol⁻¹
ChemAxon
Polarizability
1.78 ų
ChemAxon
Number of Rings
0
ChemAxon
Bioavailability
1
ChemAxon
Rule of Five
Yes
ChemAxon
Ghose Filter
No
ChemAxon
Veber's Rule
Yes
ChemAxon
MDDR-like Rule
No
ChemAxon
Spectra
Spectra
Spectrum Type
Description
Splash Key
View
Predicted LC-MS/MS
Predicted LC-MS/MS Spectrum - 10V, Positive
splash10-0udi-9000000000-ad2780f1f48b7aca8012
Spectrum
Predicted LC-MS/MS
Predicted LC-MS/MS Spectrum - 20V, Positive
splash10-0udi-9000000000-ad2780f1f48b7aca8012
Spectrum
Predicted LC-MS/MS
Predicted LC-MS/MS Spectrum - 40V, Positive
splash10-0udi-9000000000-ad2780f1f48b7aca8012
Spectrum
Predicted LC-MS/MS
Predicted LC-MS/MS Spectrum - 10V, Negative
splash10-0udi-9000000000-f010964c6795d9f5713a
Spectrum
Predicted LC-MS/MS
Predicted LC-MS/MS Spectrum - 20V, Negative
splash10-0udi-9000000000-f010964c6795d9f5713a
Spectrum
Predicted LC-MS/MS
Predicted LC-MS/MS Spectrum - 40V, Negative
splash10-0udi-9000000000-f010964c6795d9f5713a
Spectrum
Toxicity Profile
Route of Exposure
Not Available
Mechanism of Toxicity
Not Available
Metabolism
Not Available
Toxicity Values
Not Available
Lethal Dose
Not Available
Carcinogenicity (
IARC Classification
)
Not Available
Uses/Sources
Not Available
Minimum Risk Level
Not Available
Health Effects
Not Available
Symptoms
Not Available
Treatment
Not Available
Concentrations
Not Available
External Links
DrugBank ID
Not Available
HMDB ID
HMDB0000599
FooDB ID
FDB003516
Phenol Explorer ID
Not Available
KNApSAcK ID
Not Available
BiGG ID
Not Available
BioCyc ID
Not Available
METLIN ID
Not Available
PDB ID
Not Available
Wikipedia Link
Chromium
Chemspider ID
25743
ChEBI ID
49544
PubChem Compound ID
27668
Kegg Compound ID
C19368
YMDB ID
Not Available
ECMDB ID
Not Available
References
Synthesis Reference
Not Available
MSDS
Not Available
General References
1
.
Gambelunghe A, Piccinini R, Ambrogi M, Villarini M, Moretti M, Marchetti C, Abbritti G, Muzi G: Primary DNA damage in chrome-plating workers. Toxicology. 2003 Jun 30;188(2-3):187-95.
2
.
Agaoglu G, Arun T, Izgi B, Yarat A: Nickel and chromium levels in the saliva and serum of patients with fixed orthodontic appliances. Angle Orthod. 2001 Oct;71(5):375-9.
3
.
Kim H, Cho SH, Chung MH: Exposure to hexavalent chromium does not increase 8-hydroxydeoxyguanosine levels in Korean chromate pigment workers. Ind Health. 1999 Jul;37(3):335-41.
4
.
MacDonald SJ, McCalden RW, Chess DG, Bourne RB, Rorabeck CH, Cleland D, Leung F: Metal-on-metal versus polyethylene in hip arthroplasty: a randomized clinical trial. Clin Orthop Relat Res. 2003 Jan;(406):282-96.
5
.
Vanoirbeek JA, Hoet PH, Nemery B, Verbeken EK, Haufroid V, Lison D, Dinsdale D: Kinetics of an intratracheally administered chromium catalyst in rats. J Toxicol Environ Health A. 2003 Feb 28;66(4):393-409.
6
.
Seifert B, Becker K, Hoffmann K, Krause C, Schulz C: The German Environmental Survey 1990/1992 (GerES II): a representative population study. J Expo Anal Environ Epidemiol. 2000 Mar-Apr;10(2):103-14.
7
.
Aguilar MV, Mateos CJ, Martinez Para MC: Determination of chromium in cerebrospinal fluid using electrothermal atomisation atomic absorption spectrometry. J Trace Elem Med Biol. 2002;16(4):221-5.
8
.
Chuang IC, Lee PN, Lin TH, Chen GS: Determination of some elements in the cervical mucus of healthy Taiwanese women, by GF-AAS. Biol Trace Elem Res. 2002 May;86(2):137-43.
9
.
Gaggelli E, Berti F, D'Amelio N, Gaggelli N, Valensin G, Bovalini L, Paffetti A, Trabalzini L: Metabolic pathways of carcinogenic chromium. Environ Health Perspect. 2002 Oct;110 Suppl 5:733-8.
10
.
Ravina A, Slezak L, Mirsky N, Bryden NA, Anderson RA: Reversal of corticosteroid-induced diabetes mellitus with supplemental chromium. Diabet Med. 1999 Feb;16(2):164-7.
11
.
Torra M, Rodamilans M, Corbella J, Ferrer R, Mazzara R: Blood chromium determination in assessing reference values in an unexposed Mediterranean population. Biol Trace Elem Res. 1999 Nov;70(2):183-9.
12
.
Kocadereli L, Atac PA, Kale PS, Ozer D: Salivary nickel and chromium in patients with fixed orthodontic appliances. Angle Orthod. 2000 Dec;70(6):431-4.
13
.
Kang EK, Lee S, Park JH, Joo KM, Jeong HJ, Chang IS: Determination of hexavalent chromium in cosmetic products by ion chromatography and postcolumn derivatization. Contact Dermatitis. 2006 May;54(5):244-8.
14
.
Liden C, Skare L, Lind B, Nise G, Vahter M: Assessment of skin exposure to nickel, chromium and cobalt by acid wipe sampling and ICP-MS. Contact Dermatitis. 2006 May;54(5):233-8.
15
.
Shigeta A, Ratanamaneechat S, Srisukho S, Tanaka M, Moriyama Y, Suwanagool S, Miki M: Epidemiological correlation between chromium content in gallstones and cholesterol in blood. J Med Assoc Thai. 2002 Feb;85(2):183-94.
16
.
Medeiros MG, Rodrigues AS, Batoreu MC, Laires A, Rueff J, Zhitkovich A: Elevated levels of DNA-protein crosslinks and micronuclei in peripheral lymphocytes of tannery workers exposed to trivalent chromium. Mutagenesis. 2003 Jan;18(1):19-24.
17
.
Vaglenov A, Nosko M, Georgieva R, Carbonell E, Creus A, Marcos R: Genotoxicity and radioresistance in electroplating workers exposed to chromium. Mutat Res. 1999 Oct 29;446(1):23-34.
18
.
Iarmarcovai G, Sari-Minodier I, Chaspoul F, Botta C, De Meo M, Orsiere T, Berge-Lefranc JL, Gallice P, Botta A: Risk assessment of welders using analysis of eight metals by ICP-MS in blood and urine and DNA damage evaluation by the comet and micronucleus assays; influence of XRCC1 and XRCC3 polymorphisms. Mutagenesis. 2005 Nov;20(6):425-32. Epub 2005 Oct 18.
19
.
Kolacinski Z, Kostrzewski P, Kruszewska S, Razniewska G, Mielczarska J: Acute potassium dichromate poisoning: a toxicokinetic case study. J Toxicol Clin Toxicol. 1999;37(6):785-91.
20
.
Morris BW, MacNeil S, Hardisty CA, Heller S, Burgin C, Gray TA: Chromium homeostasis in patients with type II (NIDDM) diabetes. J Trace Elem Med Biol. 1999 Jul;13(1-2):57-61.
21
.
Shrivastava R, Upreti RK, Seth PK, Chaturvedi UC: Effects of chromium on the immune system. FEMS Immunol Med Microbiol. 2002 Sep 6;34(1):1-7.