(1r,3s,7s,8r)-n-methyl-2-oxa-6-azatricyclo[4.2.1.03,7]nonan-8-amine (CED0211779)

Record Information

Version

1.0

Creation Date

2026-08-24 14:57:54 UTC

Update Date

2026-08-24 14:57:54 UTC

SynCED ID

CED0211779

Secondary Accession Numbers

CHEM250968

Identification

Common Name

(1r,3s,7s,8r)-n-methyl-2-oxa-6-azatricyclo[4.2.1.03,7]nonan-8-amine

Class

Small Molecule

Description

(1r,3s,7s,8r)-n-methyl-2-oxa-6-azatricyclo[4.2.1.03,7]nonan-8-amine belongs to the loline alkaloids and derivatives, a class of alkaloids and derivatives within the organic compounds. This compound has the chemical formula C8H14N2O and an average molecular weight of 154.21 g/mol. There are three recorded sources from which this substance is found in or released. These include electrical and electronic equipment, specifically line transmission systems, as well as food, food processing and cookware, specifically the processing of meats and the preparation of wort.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₈H₁₄N₂O

Average Molecular Mass

154.210 g/mol

Monoisotopic Mass

154.111 g/mol

CAS Registry Number

25161-91-5

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C8H14N2O/c1-9-7-6-4-10-3-2-5(11-6)8(7)10/h5-9H,2-4H2,1H3/t5-,6+,7-,8+/m0/s1

InChI Key

OPMNROCQHKJDAQ-FKSUSPILSA-N

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

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
2228.0 Log mg/kg [1300:4000]	Rat	LD50	oral	predicted	Not Available	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
CEDs000511	Conductors Or Conductive Bodies Characterised By The Conductive Materials?Conductors, or conductive bodies, are materials that allow the flow of electrical current, typically made from metals such as copper, aluminum, or silver.	Electrical & Electronic Equipment	PubChem
CEDs000524	Hybrid Capacitors?Hybrid capacitors are energy storage devices that combine the properties of electrolytic and supercapacitors, utilizing a combination of electrochemical principles to achieve higher energy density and power density.	Electrical & Electronic Equipment	PubChem
CEDs000525	Line Transmission Systems?Line Transmission Systems, commonly used for the distribution of electrical energy, can be a source of synthetic chemical contamination through the insulation materials and coatings utilized in their construction.	Electrical & Electronic Equipment	PubChem
CEDs000544	Fermentation Processes For Beer?Fermentation processes for beer involve the conversion of sugars into alcohol and carbon dioxide by yeast.	Food, food processing & cookware	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
CEDs000550	Preparation Of Wort?The preparation of wort involves the extraction of sugars from malted grains, a crucial step in the brewing process.	Food, food processing & cookware	PubChem
CEDs000552	Processing Meats?Processing meats can lead to synthetic chemical contamination primarily through the use of additives and preservatives.	Food, food processing & cookware	PubChem
CEDs000561	Perfumes Within Detergents And Soaps?Perfumes within detergents and soaps are synthetic fragrance compounds added to enhance the sensory experience of cleaning products.	Household cleaning & consumer products	PubChem
CEDs000563	Soap Detergents?Soap detergents are synthetic surfactants designed to enhance the cleaning efficacy of water by reducing surface tension, allowing for better interaction with dirt and grease.	Household cleaning & consumer products	PubChem
CEDs000579	Manufacture Of Iron Or Steel?The manufacture of iron or steel involves various processes, including smelting, refining, and alloying, which can result in the release of synthetic chemicals and contaminants.	Industrial manufacturing & chemical processing	PubChem
CEDs000600	Herbicides And Algicides?Herbicides and algicides are synthetic chemicals primarily used to control unwanted plants and algae in various environments.	Agriculture & land management	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
CEDs000614	Essential Oils Or Perfumes?Essential oils and perfumes are complex mixtures of volatile compounds derived from natural or synthetic sources, commonly used for their aromatic properties.	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
CEDs000638	Decorating Textiles?Decorating textiles often involves the use of synthetic chemicals such as dyes, finishes, and coatings.	Textiles, leather & furnishings	PubChem
CEDs000679	Phosphatic Fertilisers?Phosphatic fertilizers are synthetic chemical products primarily composed of phosphorus, which is essential for plant growth.	Agriculture & land management	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
CEDs000739	Inks?Inks are complex mixtures composed of pigments or dyes, solvents, resins, and additives used primarily for printing and writing applications.	Paper, pulp & fiber products	PubChem
CEDs000744	Water, Wastewater, & Sewage Treatment?Water, wastewater, and sewage treatment processes are critical for managing and mitigating pollutants in water systems.	Wastewater, sanitation & biosolids	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	Alpha-1,2-mannosidase (BT_3990)	Q8A0N1	Bacteroides thetaiotaomicron	Predicted (SEA)	Prediction Confidence Score 0.231 Applicability Domain 0.231 Low confidence Statistical Significance 1.50e-04 Supporting Reference Compounds 1 E-value 1.16774
Click to view 3D structure	Histamine H3 receptor	Q9Y5N1	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.185 Low confidence Statistical Significance 0.8822 Supporting Reference Compounds 294 E-value 6867.55
Click to view 3D structure	Histamine H4 receptor	Q9H3N8	Humans	Predicted (SEA)	Prediction Confidence Score 0.172 Applicability Domain 0.185 Low confidence Statistical Significance 0.7754 Supporting Reference Compounds 150 E-value 6036.43
Click to view 3D structure	Serine-threonine protein phosphatase 2A regulatory subunit	Q8AWE3	Gallus gallus	Predicted (SEA)	Prediction Confidence Score 0.163 Applicability Domain 0.189 Low confidence Statistical Significance 0.0188 Supporting Reference Compounds 12 E-value 146.434
Click to view 3D structure	Histamine H4 receptor	Q91ZY2	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.162 Applicability Domain 0.185 Low confidence Statistical Significance 0.2195 Supporting Reference Compounds 21 E-value 1709.1
Click to view 3D structure	Substance-P receptor	P30547	Cavia porcellus	Predicted (SEA)	Prediction Confidence Score 0.161 Applicability Domain 0.167 Low confidence Statistical Significance 0.4866 Supporting Reference Compounds 29 E-value 3788.45
Click to view 3D structure	Substance-K receptor	P21452	Humans	Predicted (SEA)	Prediction Confidence Score 0.158 Applicability Domain 0.167 Low confidence Statistical Significance 0.8577 Supporting Reference Compounds 118 E-value 6676.82
Click to view 3D structure	Voltage-gated inwardly rectifying potassium channel KCNH2	Q12809	Humans	Predicted (SEA)	Prediction Confidence Score 0.158 Applicability Domain 0.172 Low confidence Statistical Significance 0.9938 Supporting Reference Compounds 1498 E-value 7736.34
Click to view 3D structure	5-hydroxytryptamine receptor 2B	P41595	Humans	Predicted (SEA)	Prediction Confidence Score 0.156 Applicability Domain 0.167 Low confidence Statistical Significance 0.9888 Supporting Reference Compounds 686 E-value 7698.04
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q99720	Humans	Predicted (SEA)	Prediction Confidence Score 0.156 Applicability Domain 0.173 Low confidence Statistical Significance 0.9827 Supporting Reference Compounds 562 E-value 7650.4
Click to view 3D structure	Histamine H4 receptor	Q91ZY1	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.154 Applicability Domain 0.172 Low confidence Statistical Significance 0.3016 Supporting Reference Compounds 22 E-value 2347.7
Click to view 3D structure	Sigma intracellular receptor 2	Q5BJF2	Humans	Predicted (SEA)	Prediction Confidence Score 0.154 Applicability Domain 0.173 Low confidence Statistical Significance 0.9762 Supporting Reference Compounds 308 E-value 7599.8
Click to view 3D structure	Histamine H1 receptor	P35367	Humans	Predicted (SEA)	Prediction Confidence Score 0.153 Applicability Domain 0.167 Low confidence Statistical Significance 0.9848 Supporting Reference Compounds 507 E-value 7666.28
Click to view 3D structure	Neuronal acetylcholine receptor subunit alpha-7	P36544	Humans	Predicted (SEA)	Prediction Confidence Score 0.153 Applicability Domain 0.184 Low confidence Statistical Significance 0.8617 Supporting Reference Compounds 77 E-value 6708.19
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q60492	Cavia porcellus	Predicted (SEA)	Prediction Confidence Score 0.152 Applicability Domain 0.173 Low confidence Statistical Significance 0.92 Supporting Reference Compounds 229 E-value 7162.52
Click to view 3D structure	5-hydroxytryptamine receptor 2A	P28223	Humans	Predicted (SEA)	Prediction Confidence Score 0.152 Applicability Domain 0.167 Low confidence Statistical Significance 0.9921 Supporting Reference Compounds 955 E-value 7723.11
Click to view 3D structure	Substance-P receptor	P14600	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.151 Applicability Domain 0.167 Low confidence Statistical Significance 0.4946 Supporting Reference Compounds 34 E-value 3850.73
Click to view 3D structure	HTH-type quorum-sensing regulator RhlR	P54292	Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 / 1C / PRS 101 / LMG12228)	Predicted (SEA)	Prediction Confidence Score 0.151 Applicability Domain 0.151 Low confidence Statistical Significance 0.0663 Supporting Reference Compounds 1 E-value 516.14
Click to view 3D structure	Sodium-dependent serotonin transporter	P31645	Humans	Predicted (SEA)	Prediction Confidence Score 0.151 Applicability Domain 0.158 Low confidence Statistical Significance 0.9903 Supporting Reference Compounds 593 E-value 7709.41
Click to view 3D structure	D(2) dopamine receptor	P61169	Rat	Predicted (SEA)	Prediction Confidence Score 0.15 Applicability Domain 0.154 Low confidence Statistical Significance 0.9678 Supporting Reference Compounds 528 E-value 7533.94
Click to view 3D structure	Histamine H3 receptor	Q9QYN8	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.15 Applicability Domain 0.169 Low confidence Statistical Significance 0.8573 Supporting Reference Compounds 80 E-value 6673.86
Click to view 3D structure	Substance-P receptor	P25103	Humans	Predicted (SEA)	Prediction Confidence Score 0.15 Applicability Domain 0.167 Low confidence Statistical Significance 0.9079 Supporting Reference Compounds 122 E-value 7067.7
Click to view 3D structure	Alpha-mannosidase 2C1	P21139	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.149 Applicability Domain 0.231 Low confidence Statistical Significance 7.10e-04 Supporting Reference Compounds 2 E-value 5.52729
Click to view 3D structure	Muscarinic acetylcholine receptor M1	P11229	Humans	Predicted (SEA)	Prediction Confidence Score 0.149 Applicability Domain 0.159 Low confidence Statistical Significance 0.9877 Supporting Reference Compounds 385 E-value 7689.48
Click to view 3D structure	D(3) dopamine receptor	P35462	Humans	Predicted (SEA)	Prediction Confidence Score 0.148 Applicability Domain 0.154 Low confidence Statistical Significance 0.992 Supporting Reference Compounds 861 E-value 7722.64