AFCDB: Magnesium (FDB003518)

Record Information

Version

1.0

Creation date

2010-04-08 22:05:50 UTC

Update date

2024-11-29 22:28:12 UTC

Primary ID

FDB003518

Secondary Accession Numbers

Not Available

Chemical Information

FooDB Name

Magnesium

Description

Magnesium, also known as magnesium ion or MG2+, belongs to the class of inorganic compounds known as homogeneous alkaline earth metal compounds. These are inorganic compounds containing only metal atoms,with the largest atom being a alkaline earth metal atom. Magnesium is possibly neutral. Magnesium exists in all living species, ranging from bacteria to humans. In humans, magnesium is involved in mercaptopurine action pathway. Outside of the human body, Magnesium has been detected, but not quantified in, several different foods, such as cereals and cereal products, sunburst squash (pattypan squash), barley, gram beans, and lingonberries. This could make magnesium a potential biomarker for the consumption of these foods. Magnesium, with regard to humans, has been found to be associated with several diseases such as multiple sclerosis, bartter syndrome, type 1, antenatal, seizures, sensorineural deafness, ataxia, mental retardation, and electrolyte imbalance (sesames), and bartter syndrome, type 2, antenatal; magnesium has also been linked to the inborn metabolic disorder primary hypomagnesemia.

CAS Number

7439-95-4

Structure

MOL SDF PDB SMILES InChI

Synonyms

Synonym	Source
Not Available	Not Available

Predicted Properties

Property	Value	Source
logP	-0.57	ChemAxon
pKa (Strongest Acidic)	3.09	ChemAxon
Physiological Charge	2	ChemAxon
Hydrogen Acceptor Count	0	ChemAxon
Hydrogen Donor Count	0	ChemAxon
Polar Surface Area	0 Å²	ChemAxon
Rotatable Bond Count	0	ChemAxon
Refractivity	0 m³·mol⁻¹	ChemAxon
Polarizability	1.78 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	Yes	ChemAxon
MDDR-like Rule	No	ChemAxon

Chemical Formula

IUPAC name

magnesium(2+) ion

InChI Identifier

InChI=1S/Mg/q+2

InChI Key

JLVVSXFLKOJNIY-UHFFFAOYSA-N

Isomeric SMILES

[Mg++]

Average Molecular Weight

24.305

Monoisotopic Molecular Weight

23.985041898

Classification

Description

Belongs to the class of inorganic compounds known as homogeneous alkaline earth metal compounds. These are inorganic compounds containing only metal atoms,with the largest atom being a alkaline earth metal atom.

Kingdom

Inorganic compounds

Super Class

Homogeneous metal compounds

Class

Homogeneous alkaline earth metal compounds

Sub Class

Not Available

Direct Parent

Homogeneous alkaline earth metal compounds

Alternative Parents

Not Available

Substituents

Homogeneous alkaline earth metal

Molecular Framework

Not Available

External Descriptors

monoatomic dication (CHEBI:18420 )
divalent metal cation (CHEBI:18420 )
magnesium cation (CHEBI:18420 )
a cation (MG+2 )

Ontology

No ontology term

Physico-Chemical Properties

Physico-Chemical Properties - Experimental

Property	Value	Reference
Physical state	Solid
Physical Description	Not Available
Mass Composition	Not Available
Melting Point	651 oC
Boiling Point	Not Available
Experimental Water Solubility	Not Available
Experimental logP	Not Available
Experimental pKa	Not Available
Isoelectric point	Not Available
Charge	Not Available
Optical Rotation	Not Available
Spectroscopic UV Data	Not Available
Density	Not Available
Refractive Index	Not Available

Spectra

Not Available

External Links

ChemSpider ID

865

ChEMBL ID

Not Available

KEGG Compound ID

C00305

Pubchem Compound ID

888

Pubchem Substance ID

Not Available

ChEBI ID

Not Available

Phenol-Explorer ID

Not Available

DrugBank ID

DB01378

HMDB ID

HMDB00547

CRC / DFC (Dictionary of Food Compounds) ID

Not Available

EAFUS ID

Not Available

Dr. Duke ID

MAGNESIUM

BIGG ID

Not Available

KNApSAcK ID

Not Available

HET ID

Food Biomarker Ontology

Not Available

VMH ID

Not Available

Flavornet ID

Not Available

GoodScent ID

Not Available

SuperScent ID

Not Available

Wikipedia ID

Magnesium

Phenol-Explorer Metabolite ID

Not Available

Duplicate IDS

Not Available

Old DFC IDS

Not Available

Associated Foods

Food	Content Range	Average	Reference
Food			Reference

Biological Effects and Interactions

Health Effects / Bioactivities

Descriptor	ID	Definition	Reference
anti aggregant			DUKE
anti alcoholic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti anginal	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti anorectic	50780	An agent which regulates the physiologic mechanisms that control the appetite and food intake.	DUKE
anti anxiety	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti arrhythmic	38070	A drug used for the treatment or prevention of cardiac arrhythmias. Anti-arrhythmia drugs may affect the polarisation-repolarisation phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibres.	DUKE
anti arthritic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti asthmatic	49167	A drug used to treat asthma.	DUKE
anti atherosclerotic	38070	A drug used for the treatment or prevention of cardiac arrhythmias. Anti-arrhythmia drugs may affect the polarisation-repolarisation phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibres.	DUKE
anti cephalagic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti CFS			DUKE
anti climacteric			DUKE
anti convulsant	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti coronary	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti depressant	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti diabetic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti dysmenorrheic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti endometriotic			DUKE
anti enterotic			DUKE
anti epileptic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti fatigue	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti fibromyalgic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti gastrotic	55324	A drug used for its effects on the gastrointestinal system, e.g. controlling gastric acidity, regulating gastrointestinal motility and water flow, and improving digestion.	DUKE
anti glaucomic			DUKE
anti hyperkinetic			DUKE
anti hypertensive	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti hypoglycemic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti inflammatory	35472	A substance that reduces or suppresses inflammation.	DUKE
anti insomniac	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti lithic			DUKE
anti Lyme	33281	A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.	DUKE
anti mastalgic			DUKE
anti menopausal	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti migraine	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti mitral-valve-prolapse	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti monosodium-glutamate			DUKE
anti nephrolytic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti neurotic			DUKE
anti osteoporotic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti plaque			DUKE
anti premenstrual syndrome	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti Raynaud's	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti retinopathic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti spasmodic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti spasmophilic	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti stress	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti stroke	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anti syndrome-X	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
anxiolytic	35474	Anxiolytic drugs are agents that alleviate anxiety, tension, and anxiety disorders, promote sedation, and have a calming effect without affecting clarity of consciousness or neurologic conditions.	DUKE
calcium antagonist	48706	Substance that attaches to and blocks cell receptors that normally bind naturally occurring substances.	DUKE
cardioprotective	38070	A drug used for the treatment or prevention of cardiac arrhythmias. Anti-arrhythmia drugs may affect the polarisation-repolarisation phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibres.	DUKE
central nervous system depressant	35470	A class of drugs producing both physiological and psychological effects through a variety of mechanisms involving the central nervous system.	DUKE
diuretic	35498	An agent that promotes the excretion of urine through its effects on kidney function.	DUKE
hypocholesterolemic			DUKE
hypotensive			DUKE
immunomodulator	50846	Biologically active substance whose activity affects or plays a role in the functioning of the immune system.	DUKE
insulinogenic			DUKE
laxative	50503	An agent that produces a soft formed stool, and relaxes and loosens the bowels, typically used over a protracted period, to relieve constipation. Compare with cathartic, which is a substance that accelerates defecation. A substances can be both a laxative and a cathartic.	DUKE
litholytic			DUKE
myorelaxant			DUKE
neurotransmitter	25512	An endogenous compound that is used to transmit information across the synapse between a neuron and another cell.	DUKE
tranquilizer			DUKE
utero relaxant	52217	Any substance introduced into a living organism with therapeutic or diagnostic purpose.	DUKE
vasodilator	35620	A drug used to cause dilation of the blood vessels.	DUKE

Enzymes

Name	Gene Name	UniProt ID
6-phosphogluconolactonase	PGLS	O95336
Sodium/potassium-transporting ATPase subunit beta-3	ATP1B3	P54709
Sodium/potassium-transporting ATPase subunit beta-2	ATP1B2	P14415
Cytosolic 5'-nucleotidase 3	NT5C3	Q9H0P0
Rho-related GTP-binding protein RhoU	RHOU	Q7L0Q8
DNA-(apurinic or apyrimidinic site) lyase	APEX1	P27695

Pathways

Name	SMPDB Link	KEGG Link
Metabolism and Physiological Effects of Phenylacetylglutamine	SMP0123208	Not Available
Metabolism and Physiological Effects of Homocysteine	SMP0123280	Not Available
Metabolism and Physiological Effects of Uridine	SMP0124871	Not Available
Metabolism and Physiological Effects of S-Adenosylhomocysteine	SMP0127690	Not Available

Metabolism

Not Available

Biosynthesis

Not Available

Organoleptic Properties

Flavours

Not Available

Files

MSDS

show

References

Synthesis Reference

Not Available

General Reference

Not Available

Content Reference

— Saxholt, E., et al. 'Danish food composition databank, revision 7.' Department of Nutrition, National Food Institute, Technical University of Denmark (2008).
— U.S. Department of Agriculture, Agricultural Research Service. 2008. USDA National Nutrient Database for Standard Reference, Release 21. Nutrient Data Laboratory Home Page.
— Duke, James. 'Dr. Duke's Phytochemical and Ethnobotanical Databases. United States Department of Agriculture.' Agricultural Research Service, Accessed April 27 (2004).

Magnesium (FDB003518)

Structure for FDB003518 (Magnesium)