Magaldrate (CED0017690)

Record Information

Version

1.0

Creation Date

2026-04-06 14:10:12 UTC

Update Date

2026-05-14 19:00:59 UTC

SynCED ID

CED0017690

Secondary Accession Numbers

CHEM126357

Identification

Common Name

Magaldrate

Class

Small Molecule

Description

Magaldrate is an inorganic compound with the formula AlH3MgO2 and an average molecular weight of 86.31 g/mol. Magaldrate belongs to the post-transition metal hydroxides, a subclass of post-transition metal oxoanionic compounds within the inorganic compounds. It is categorized as a mixed metal/non-metal compound. This substance is found in or released from healthcare, pharmaceuticals, and veterinary products, specifically those used as drugs for acid related disorders. The recorded route of exposure for this compound is oral.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

AlH₃MgO₂

Average Molecular Mass

86.309 g/mol

Monoisotopic Mass

85.980 g/mol

CAS Registry Number

74978-16-8

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

O.[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Mg++].[Al+3].[Al+3].[Al+3].[Al+3].[Al+3].[O-]S([O-])(=O)=O.[O-]S([O-])(=O)=O

InChI Identifier

InChI=1S/Al.Mg.2H2O/h;;2*1H2/p-1

InChI Key

SXSTVPXRZQQBKQ-UHFFFAOYSA-M

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

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

Not Available

Spectra

Not Available

Toxicity Profile

Toxicity Values

Not Available

Toxicity / Toxin Class

Not Available

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Health Effects

Health Effect	Relationship	Direction	Description	Reference

Exposure Sources

Source ID	Source	Sector	Reference
CEDs000242	Drugs for acid related disorders?Drugs for acid-related disorders primarily include proton pump inhibitors (PPIs), H2 receptor antagonists, and antacids, which are used to manage conditions such as gastroesophageal reflux disease (GERD) and peptic ulcers.	Healthcare, pharmaceuticals & veterinary products	Not Available
CEDs000518	Electrically Stimulated Smoking Devices?Electrically stimulated smoking devices, commonly known as e-cigarettes or vape pens, utilize electrical components to heat a liquid solution, often containing nicotine, flavorings, and other additives, to produce an aerosol for inhalation.	Electrical & Electronic Equipment	PubChem
CEDs000545	Food Preservation?Food preservation often involves the use of synthetic chemicals, such as preservatives, flavor enhancers, and color additives, to extend shelf life and enhance the sensory qualities of food products.	Food, food processing & cookware	PubChem
CEDs000559	Non Electric Simulated Smoking Devices?Non-electric simulated smoking devices, often designed to mimic the experience of smoking without combustion, can be sources of synthetic chemical contamination due to the materials and chemicals used in their construction and operation.	Household cleaning & consumer products	PubChem
CEDs000580	Manufacture Preparation Of Tobacco Products?The manufacture and preparation of tobacco products involve various processes that can result in the introduction of synthetic chemicals into the environment.	Industrial manufacturing & chemical processing	PubChem
CEDs000609	Aftershave?Aftershave is a grooming product typically used to soothe and protect the skin following shaving.	Personal care & cosmetics	PubChem
CEDs000610	Aftersun Products?Aftersun products are designed to soothe and hydrate the skin after sun exposure, often containing various synthetic chemicals such as emollients, preservatives, and fragrances.	Personal care & cosmetics	PubChem
CEDs000611	Anti Perspirants Or Body Deoderants?Antiperspirants and body deodorants commonly contain synthetic chemicals such as aluminum compounds, parabens, and synthetic fragrances.	Personal care & cosmetics	PubChem
CEDs000632	Apparel?Apparel production often involves the use of various synthetic chemicals, including dyes, finishing agents, and preservatives.	Textiles, leather & furnishings	PubChem
CEDs000642	Footwear?Footwear production often involves the use of various synthetic chemicals, such as adhesives, dyes, and treatments, which can contribute to environmental contamination.	Textiles, leather & furnishings	PubChem
CEDs000678	Nitrogenous Fertilisers?Nitrogenous fertilizers are synthetic chemical compounds primarily used to enhance plant growth by supplying essential nitrogen, a crucial nutrient for photosynthesis and protein synthesis.	Agriculture & land management	PubChem
CEDs000684	Cements?Cements are a composite material primarily used as a binding agent in construction applications, formed by the calcination of limestone and clay minerals at high temperatures.	Building & Construction	PubChem
CEDs000685	Ceramics?Ceramics can be a source of synthetic chemical contamination through various additives and processing agents used in their production.	Building & Construction	PubChem
CEDs000696	Nanotechnology?Nanotechnology involves the manipulation of materials at the molecular or atomic level, typically within the range of 1 to 100 nanometers.	Industrial manufacturing & chemical processing	PubChem

Pathways

0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Carbonic anhydrase 15	Q99N23	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.159 Applicability Domain 0.174 Low confidence Statistical Significance 0.61 Supporting Reference Compounds 78 E-value 4748.8
Click to view 3D structure	Carbonic anhydrase 5A, mitochondrial	P35218	Humans	Predicted (SEA)	Prediction Confidence Score 0.158 Applicability Domain 0.172 Low confidence Statistical Significance 0.802 Supporting Reference Compounds 165 E-value 6243.66
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	Prediction Confidence Score 0.189 Applicability Domain 0.231 Low confidence Statistical Significance 0.6449 Supporting Reference Compounds 372 E-value 5020.19
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	Prediction Confidence Score 0.189 Applicability Domain 0.231 Low confidence Statistical Significance 0.7056 Supporting Reference Compounds 472 E-value 5492.73
Click to view 3D structure	Carbonic anhydrase 7	P43166	Humans	Predicted (SEA)	Prediction Confidence Score 0.189 Applicability Domain 0.231 Low confidence Statistical Significance 0.5486 Supporting Reference Compounds 242 E-value 4270.81
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	Prediction Confidence Score 0.189 Applicability Domain 0.231 Low confidence Statistical Significance 0.6534 Supporting Reference Compounds 407 E-value 5086.36
Click to view 3D structure	Alpha carbonic anhydrase	B5SU02	Stylophora pistillata	Predicted (SEA)	Prediction Confidence Score 0.187 Applicability Domain 0.231 Low confidence Statistical Significance 0.0491 Supporting Reference Compounds 43 E-value 381.928
Click to view 3D structure	Carbonic anhydrase	C0IX24	Stylophora pistillata	Predicted (SEA)	Prediction Confidence Score 0.187 Applicability Domain 0.231 Low confidence Statistical Significance 0.049 Supporting Reference Compounds 41 E-value 381.617
Click to view 3D structure	Carbonic anhydrase 4	P22748	Humans	Predicted (SEA)	Prediction Confidence Score 0.186 Applicability Domain 0.231 Low confidence Statistical Significance 0.511 Supporting Reference Compounds 193 E-value 3978.41
Click to view 3D structure	Carbonic anhydrase 6	P23280	Humans	Predicted (SEA)	Prediction Confidence Score 0.185 Applicability Domain 0.231 Low confidence Statistical Significance 0.441 Supporting Reference Compounds 151 E-value 3433.23
Click to view 3D structure	Carbonic anhydrase	P40881	Methanosarcina thermophila	Predicted (SEA)	Prediction Confidence Score 0.182 Applicability Domain 0.231 Low confidence Statistical Significance 0.0241 Supporting Reference Compounds 22 E-value 187.305
Click to view 3D structure	Dual specificity protein phosphatase 5	Q16690	Humans	Predicted (SEA)	Prediction Confidence Score 0.179 Applicability Domain 0.179 Low confidence Statistical Significance 0.0029 Supporting Reference Compounds 1 E-value 22.3427
Click to view 3D structure	Astrosclerin-3	A6YCJ1	Astrosclera willeyana	Predicted (SEA)	Prediction Confidence Score 0.176 Applicability Domain 0.231 Low confidence Statistical Significance 0.0817 Supporting Reference Compounds 44 E-value 636.262
Click to view 3D structure	Carbonic anhydrase	P53615	Saccharomyces cerevisiae S288c	Predicted (SEA)	Prediction Confidence Score 0.167 Applicability Domain 0.231 Low confidence Statistical Significance 0.0923 Supporting Reference Compounds 34 E-value 718.938
Click to view 3D structure	Carbonic anhydrase 12	O43570	Humans	Predicted (SEA)	Prediction Confidence Score 0.166 Applicability Domain 0.174 Low confidence Statistical Significance 0.8527 Supporting Reference Compounds 332 E-value 6638.2
Click to view 3D structure	Carbonic anhydrase	Q5AJ71	Candida albicans (strain SC5314 / ATCC MYA-2876) (Yeast)	Predicted (SEA)	Prediction Confidence Score 0.164 Applicability Domain 0.174 Low confidence Statistical Significance 0.4114 Supporting Reference Compounds 68 E-value 3203.03
Click to view 3D structure	Beta-carbonic anhydrase 1	P9WPJ7	Mycobacterium tuberculosis	Predicted (SEA)	Prediction Confidence Score 0.164 Applicability Domain 0.174 Low confidence Statistical Significance 0.336 Supporting Reference Compounds 55 E-value 2616.12
Click to view 3D structure	Carbonic anhydrase 2	P00921	Bos taurus	Predicted (SEA)	Prediction Confidence Score 0.164 Applicability Domain 0.174 Low confidence Statistical Significance 0.1147 Supporting Reference Compounds 22 E-value 893.086
Click to view 3D structure	Carbonic anhydrase 2	Q3I4V7	Cryptococcus neoformans	Predicted (SEA)	Prediction Confidence Score 0.163 Applicability Domain 0.174 Low confidence Statistical Significance 0.4266 Supporting Reference Compounds 60 E-value 3321.36
Click to view 3D structure	Carbonic anhydrase 5B, mitochondrial	Q9Y2D0	Humans	Predicted (SEA)	Prediction Confidence Score 0.163 Applicability Domain 0.174 Low confidence Statistical Significance 0.6929 Supporting Reference Compounds 157 E-value 5394.56
Click to view 3D structure	Delta carbonic anhydrase	Q5U9J1	Conticribra weissflogii	Predicted (SEA)	Prediction Confidence Score 0.162 Applicability Domain 0.174 Low confidence Statistical Significance 0.1172 Supporting Reference Compounds 35 E-value 912.159
Click to view 3D structure	Carbonic anhydrase	Q6FTL6	Candida glabrata CBS 138	Predicted (SEA)	Prediction Confidence Score 0.161 Applicability Domain 0.174 Low confidence Statistical Significance 0.2705 Supporting Reference Compounds 46 E-value 2105.51
Click to view 3D structure	Carbonate dehydratase	B2V8E3	Sulfurihydrogenibium sp. (strain YO3AOP1)	Predicted (SEA)	Prediction Confidence Score 0.159 Applicability Domain 0.174 Low confidence Statistical Significance 0.1414 Supporting Reference Compounds 40 E-value 1101.02
Click to view 3D structure	Carbonic anhydrase	O24855	Helicobacter pylori (strain ATCC 700392 / 26695) (Campylobacterpylori)	Predicted (SEA)	Prediction Confidence Score 0.159 Applicability Domain 0.174 Low confidence Statistical Significance 0.1687 Supporting Reference Compounds 38 E-value 1313.08
Click to view 3D structure	Carbonic anhydrase, alpha family	Q31FD6	Thiomicrospira crunogena	Predicted (SEA)	Prediction Confidence Score 0.159 Applicability Domain 0.174 Low confidence Statistical Significance 0.1414 Supporting Reference Compounds 41 E-value 1101.1