Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, (5alpha)- (CED0012909)

Record Information

Version

1.0

Creation Date

2026-04-06 09:11:21 UTC

Update Date

2026-05-21 09:27:37 UTC

SynCED ID

CED0012909

Secondary Accession Numbers

CHEM121261

Identification

Common Name

Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, (5alpha)-

Class

Small Molecule

Description

Morphinan-6-one, 4,5-epoxy-14-hydroxy-3-methoxy-, (5alpha)- belongs to the phenanthrenes and derivatives, a class of benzenoids within the organic compounds. This compound has been identified in or released from 13 recorded sources across several diverse sectors. Within the electrical and electronic equipment sector, it is associated with batteries, capacitors, printed circuit boards, wires and cables, cell phones, and one additional source. In the realm of textiles, leather and furnishings, it is found in carpets, rugs, and synthetic textiles. Further recorded sources include food packaging from the food, food processing and cookware sector, and medical devices from the healthcare, pharmaceuticals and veterinary products sector. Additionally, the compound is present in lubricants used within both the energy, oil and gas sector as well as the industrial manufacturing and chemical processing sector. One further sector has also been recorded as a source. Human exposure to this substance may occur through three recorded routes: oral, inhalation, and touch.

Contaminant Type

PFAS

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

Not Available

Average Molecular Mass

Not Available

Monoisotopic Mass

Not Available

CAS Registry Number

Not Available

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C17H19NO4/c1-21-11-3-2-9-8-12-17(20)5-4-10(19)15-16(17,6-7-18-12)13(9)14(11)22-15/h2-3,12,15,18,20H,4-8H2,1H3

InChI Key

RIKMCJUNPCRFMW-UHFFFAOYSA-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

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
CEDs000007	Pesticides?Pesticides are synthetic chemicals designed to prevent, destroy, or control pests that threaten crops and agricultural productivity.	Agriculture & land management	Not Available
CEDs000120	Wires and cables?Wires and cables are integral components in the transmission of electrical power and signals.	Electrical & Electronic Equipment	Not Available
CEDs000121	Printed circuit boards?Printed circuit boards (PCBs) are essential components in the manufacturing of electronic devices, serving as the backbone for electrical connections and circuit pathways.	Electrical & Electronic Equipment	Not Available
CEDs000125	Batteries?Batteries are devices that store and release electrical energy through electrochemical reactions.	Electrical & Electronic Equipment	Not Available
CEDs000130	Semiconductors?Semiconductors are materials that possess electrical conductivity between that of conductors and insulators, making them essential for various electronic applications, including transistors, diodes, and integrated circuits.	Electrical & Electronic Equipment	Not Available
CEDs000138	Lubricants?Lubricants are synthetic or petroleum-derived substances used to reduce friction between surfaces in machinery and equipment, enhancing operational efficiency and longevity.	Energy, oil & gas	Not Available
CEDs000147	Food packaging?Food packaging often utilizes synthetic chemicals, such as plastics and coatings, to enhance durability, moisture resistance, and shelf life.	Food, food processing & cookware	Not Available
CEDs000174	Lubricants?Lubricants are synthetic or petroleum-based substances used to reduce friction and wear between moving parts in machinery and equipment.	Industrial manufacturing & chemical processing	Not Available
CEDs000234	Medical devices?Medical devices often incorporate synthetic chemicals in their manufacturing processes, which can contribute to contamination in healthcare settings.	Healthcare, pharmaceuticals & veterinary products	Not Available
CEDs000451	Carpets and Rugs?Carpets and rugs are commonly manufactured using synthetic fibers such as nylon, polyester, and polypropylene, which can be derived from petrochemical sources.	Textiles, leather & furnishings	Not Available
CEDs000454	Synthetic textiles?Synthetic textiles are materials derived from man-made fibers, such as polyester, nylon, and acrylic, which are produced through chemical processes involving petrochemicals.	Textiles, leather & furnishings	Not Available
CEDs000490		Personal care & cosmetics	Not Available
CEDs000492	Cell phones?Cell phones contain a variety of synthetic chemicals and materials, including plastics, metals, and glass, which can contribute to environmental contamination.	Electrical & Electronic Equipment	Not Available
CEDs000493	Capacitors?Capacitors are electronic components that store and release electrical energy, often using dielectric materials that can include synthetic chemicals.	Electrical & Electronic Equipment	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	Mu-type opioid receptor	P35372	Humans	Predicted (SEA)	Prediction Confidence Score 0.492 Applicability Domain 0.656 Statistical Significance 0.0104 Supporting Reference Compounds 527 E-value 80.9632
Click to view 3D structure	Kappa-type opioid receptor	P41144	Cavia porcellus	Predicted (SEA)	Prediction Confidence Score 0.492 Applicability Domain 0.656 Statistical Significance 0.0081 Supporting Reference Compounds 199 E-value 63.1357
Click to view 3D structure	Delta-type opioid receptor	P41143	Humans	Predicted (SEA)	Prediction Confidence Score 0.484 Applicability Domain 0.656 Statistical Significance 0.0119 Supporting Reference Compounds 427 E-value 92.5627
Click to view 3D structure	Delta-type opioid receptor	P33533	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.484 Applicability Domain 0.656 Statistical Significance 0.0074 Supporting Reference Compounds 164 E-value 57.297
Click to view 3D structure	Mu-type opioid receptor	P33535	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.481 Applicability Domain 0.656 Statistical Significance 0.0107 Supporting Reference Compounds 229 E-value 83.2987
Click to view 3D structure	Kappa-type opioid receptor	P34975	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.474 Applicability Domain 0.656 Statistical Significance 0.0053 Supporting Reference Compounds 66 E-value 41.4158
Click to view 3D structure	Mu-type opioid receptor	P42866	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.474 Applicability Domain 0.656 Statistical Significance 0.0036 Supporting Reference Compounds 107 E-value 27.87
Click to view 3D structure	Mu-type opioid receptor	P97266	Cavia porcellus	Predicted (SEA)	Prediction Confidence Score 0.436 Applicability Domain 0.485 Statistical Significance 0.0146 Supporting Reference Compounds 186 E-value 113.971
Click to view 3D structure	Kappa-type opioid receptor	P41145	Humans	Predicted (SEA)	Prediction Confidence Score 0.428 Applicability Domain 0.485 Statistical Significance 0.0166 Supporting Reference Compounds 532 E-value 128.918
Click to view 3D structure	Delta-type opioid receptor	P32300	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.424 Applicability Domain 0.485 Statistical Significance 0.0151 Supporting Reference Compounds 166 E-value 117.942
Click to view 3D structure	Kappa-type opioid receptor	P33534	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.384 Applicability Domain 0.451 Statistical Significance 0.0086 Supporting Reference Compounds 61 E-value 67.1839
Click to view 3D structure	Voltage-gated inwardly rectifying potassium channel KCNH2	Q12809	Humans	Predicted (SEA)	Prediction Confidence Score 0.322 Applicability Domain 0.656 Statistical Significance 0.105 Supporting Reference Compounds 1498 E-value 817.339
Click to view 3D structure	Mu-type opioid receptor	P79350	Bos taurus	Predicted (SEA)	Prediction Confidence Score 0.314 Applicability Domain 0.444 Statistical Significance 0.002 Supporting Reference Compounds 17 E-value 15.4141
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q99720	Humans	Predicted (SEA)	Prediction Confidence Score 0.313 Applicability Domain 0.656 Statistical Significance 0.0491 Supporting Reference Compounds 562 E-value 382.395
Click to view 3D structure	Cytochrome P450 2D6	P10635	Humans	Predicted (SEA)	Prediction Confidence Score 0.299 Applicability Domain 0.451 Statistical Significance 0.1103 Supporting Reference Compounds 1130 E-value 858.755
Click to view 3D structure	Nociceptin receptor	P41146	Humans	Predicted (SEA)	Prediction Confidence Score 0.29 Applicability Domain 0.451 Statistical Significance 0.0262 Supporting Reference Compounds 73 E-value 203.654
Click to view 3D structure	Acetylcholinesterase	P22303	Humans	Predicted (SEA)	Prediction Confidence Score 0.282 Applicability Domain 0.324 Statistical Significance 0.0662 Supporting Reference Compounds 406 E-value 515.05
Click to view 3D structure	Acetylcholinesterase	O42275	Electrophorus electricus	Predicted (SEA)	Prediction Confidence Score 0.281 Applicability Domain 0.324 Statistical Significance 0.0396 Supporting Reference Compounds 206 E-value 308.205
Click to view 3D structure	Acetylcholinesterase	P04058	Torpedo californica	Predicted (SEA)	Prediction Confidence Score 0.262 Applicability Domain 0.324 Statistical Significance 0.0093 Supporting Reference Compounds 30 E-value 72.3998
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q9R0C9	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.251 Applicability Domain 0.444 Statistical Significance 0.0772 Supporting Reference Compounds 207 E-value 600.685
Click to view 3D structure	Acetylcholinesterase	P37136	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.247 Applicability Domain 0.324 Statistical Significance 0.0487 Supporting Reference Compounds 95 E-value 378.97
Click to view 3D structure	Cholinesterase	P81908	Equus caballus	Predicted (SEA)	Prediction Confidence Score 0.243 Applicability Domain 0.324 Statistical Significance 0.1205 Supporting Reference Compounds 201 E-value 938.395
Click to view 3D structure	Orexin/Hypocretin receptor type 1	O43613	Humans	Predicted (SEA)	Prediction Confidence Score 0.241 Applicability Domain 0.316 Statistical Significance 0.0322 Supporting Reference Compounds 70 E-value 250.363
Click to view 3D structure	D(1A) dopamine receptor	P21728	Humans	Predicted (SEA)	Prediction Confidence Score 0.238 Applicability Domain 0.244 Low confidence Statistical Significance 0.2106 Supporting Reference Compounds 425 E-value 1639.5
Click to view 3D structure	Tissue factor	P13726	Humans	Predicted (SEA)	Prediction Confidence Score 0.238 Applicability Domain 0.244 Low confidence Statistical Significance 0.0153 Supporting Reference Compounds 29 E-value 119.187