Aluminum chlorohydrate (CED0017525)

Record Information

Version

1.0

Creation Date

2026-04-14 18:17:18 UTC

Update Date

2026-05-14 19:10:34 UTC

SynCED ID

CED0017525

Secondary Accession Numbers

CHEM131261

Identification

Common Name

Aluminum chlorohydrate

Class

Small Molecule

Description

Aluminum chlorohydrate is an inorganic compound with the formula Al2ClH7O6 and an average molecular weight of 192.46 g/mol. Aluminum chlorohydrate belongs to the post-transition metal hydroxides, a subclass of post-transition metal oxoanionic compounds within the inorganic compounds. It is further classified as a mixed metal/non-metal compound. This substance is found in or released from two recorded sources: healthcare, pharmaceuticals & veterinary products, specifically medicated dressings and drugs for treatment of bone diseases. Recorded exposure routes for the compound include oral, topical, cutaneous, and intradermal pathways.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

Al₂ClH₇O₆

Average Molecular Mass

192.460 g/mol

Monoisotopic Mass

191.956 g/mol

CAS Registry Number

12359-72-7

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

O.[OH-].[OH-].[OH-].[OH-].[OH-].[Al+3].[Al+3].[Cl-]

InChI Identifier

InChI=1S/2Al.ClH.6H2O/h;;1H;6*1H2/q2*+3;;;;;;;/p-6

InChI Key

ZLVPDILYQLCEJO-UHFFFAOYSA-H

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

Spectrum Type	Description	Splash Key	Deposition Date	View
Predicted GC-MS	Predicted GC-MS Spectrum	splash10-0002-1900000000-a40ef233daf073dd2073	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0002-0900000000-8ec9d308f613f1191441	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0002-0900000000-8ec9d308f613f1191441	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0002-0900000000-8ec9d308f613f1191441	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0002-0900000000-f095a0f36202538b5fa8	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0002-0900000000-f095a0f36202538b5fa8	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0002-0900000000-f095a0f36202538b5fa8	Not Available	View Spectrum

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	Reference

Exposure Sources

Source ID	Source	Sector	Reference
CEDs000313	Medicated dressings?Medicated dressings are specialized wound care products that are infused with therapeutic agents to promote healing and prevent infection.	Healthcare, pharmaceuticals & veterinary products	Not Available
CEDs000367	Drugs for treatment of bone diseases?Drugs for the treatment of bone diseases, such as bisphosphonates and calcitonin, are synthetic chemicals designed to prevent bone loss and promote bone health.	Healthcare, pharmaceuticals & veterinary products	Not Available

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 2	P00918	Humans	Predicted (SEA)	Prediction Confidence Score 0.078 Applicability Domain 0.2 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 472 E-value 7784.77
Click to view 3D structure	Epidermal growth factor receptor	P00533	Humans	Predicted (SEA)	Prediction Confidence Score 0.073 Applicability Domain 0.2 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 1301 E-value 7784.69
Click to view 3D structure	Tyrosine-protein kinase Fyn	P06241	Humans	Predicted (SEA)	Prediction Confidence Score 0.073 Applicability Domain 0.2 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 707 E-value 7784.61
Click to view 3D structure	Sodium-dependent noradrenaline transporter	P23975	Humans	Predicted (SEA)	Prediction Confidence Score 0.068 Applicability Domain 0.2 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 451 E-value 7784.61
Click to view 3D structure	Protein Gpr39	A6QR73	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.063 Applicability Domain 0.2 Low confidence Statistical Significance 0.9209 Supporting Reference Compounds 4 E-value 7169.52
Click to view 3D structure	Androgen receptor	P15207	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.061 Applicability Domain 0.2 Low confidence Statistical Significance 0.9999 Supporting Reference Compounds 73 E-value 7784.14
Click to view 3D structure	Phospholipase B	Q9P8P2	Cryptococcus neoformans	Predicted (SEA)	Prediction Confidence Score 0.059 Applicability Domain 0.059 Low confidence Statistical Significance 0.0838 Supporting Reference Compounds 1 E-value 652.454
Click to view 3D structure	DCN1-like protein 4	Q92564	Humans	Predicted (SEA)	Prediction Confidence Score 0.058 Applicability Domain 0.058 Low confidence Statistical Significance 0.8033 Supporting Reference Compounds 1 E-value 6253.86
Click to view 3D structure	DCN1-like protein 3	Q8IWE4	Humans	Predicted (SEA)	Prediction Confidence Score 0.058 Applicability Domain 0.058 Low confidence Statistical Significance 0.8033 Supporting Reference Compounds 1 E-value 6253.86
Click to view 3D structure	DCN1-like protein 2	Q6PH85	Humans	Predicted (SEA)	Prediction Confidence Score 0.058 Applicability Domain 0.058 Low confidence Statistical Significance 0.8033 Supporting Reference Compounds 1 E-value 6253.86
Click to view 3D structure	3',5'-cyclic-AMP phosphodiesterase 4A	O89085	Cavia porcellus	Predicted (SEA)	Prediction Confidence Score 0.057 Applicability Domain 0.057 Low confidence Statistical Significance 0.9568 Supporting Reference Compounds 1 E-value 7448.54
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	Prediction Confidence Score 0.056 Applicability Domain 0.111 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 407 E-value 7784.92
Click to view 3D structure	G-protein coupled receptor 39	O43194	Humans	Predicted (SEA)	Prediction Confidence Score 0.055 Applicability Domain 0.2 Low confidence Statistical Significance 0.9919 Supporting Reference Compounds 6 E-value 7721.86
Click to view 3D structure	5-hydroxytryptamine receptor 2A	P14842	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.047 Applicability Domain 0.054 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 380 E-value 7784.61
Click to view 3D structure	Tyrosine-protein kinase JAK2	O60674	Humans	Predicted (SEA)	Prediction Confidence Score 0.046 Applicability Domain 0.049 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 1022 E-value 7784.69
Click to view 3D structure	Glycogen synthase kinase-3 beta	P49841	Humans	Predicted (SEA)	Prediction Confidence Score 0.045 Applicability Domain 0.049 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 1157 E-value 7784.69
Click to view 3D structure	Protein kinase C theta type	Q04759	Humans	Predicted (SEA)	Prediction Confidence Score 0.045 Applicability Domain 0.049 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 356 E-value 7784.69
Click to view 3D structure	Serine/threonine-protein kinase pim-1	P11309	Humans	Predicted (SEA)	Prediction Confidence Score 0.045 Applicability Domain 0.051 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 967 E-value 7784.69
Click to view 3D structure	C-C chemokine receptor type 1	P32246	Humans	Predicted (SEA)	Prediction Confidence Score 0.044 Applicability Domain 0.053 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 54 E-value 7784.61
Click to view 3D structure	Cytochrome P450 3A4	P08684	Humans	Predicted (SEA)	Prediction Confidence Score 0.044 Applicability Domain 0.048 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 1538 E-value 7784.69
Click to view 3D structure	Cytochrome P450 1A2	P05177	Humans	Predicted (SEA)	Prediction Confidence Score 0.044 Applicability Domain 0.049 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 793 E-value 7784.69
Click to view 3D structure	C-C chemokine receptor type 8	P51685	Humans	Predicted (SEA)	Prediction Confidence Score 0.044 Applicability Domain 0.053 Low confidence Statistical Significance 0.9998 Supporting Reference Compounds 17 E-value 7783.68
Click to view 3D structure	D(2) dopamine receptor	P14416	Humans	Predicted (SEA)	Prediction Confidence Score 0.044 Applicability Domain 0.05 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 1103 E-value 7784.69
Click to view 3D structure	Carbonic anhydrase 12	O43570	Humans	Predicted (SEA)	Prediction Confidence Score 0.044 Applicability Domain 0.067 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 332 E-value 7784.69
Click to view 3D structure	D(2) dopamine receptor	P61169	Rat	Predicted (SEA)	Prediction Confidence Score 0.044 Applicability Domain 0.05 Low confidence Statistical Significance 1.0 Supporting Reference Compounds 528 E-value 7784.69