4'-Hydroxy-carvedilol (CED0047729)

Record Information
Version1.0
Creation Date2026-04-06 09:31:02 UTC
Update Date2026-05-21 10:24:36 UTC
SynCED IDCED0047729
Secondary Accession Numbers
  • CHEM121695
Identification
Common Name4'-Hydroxy-carvedilol
ClassSmall Molecule
Description
4'-Hydroxy-carvedilol belongs to the carbazoles, a subclass of indoles and derivatives within the organic compounds. This organoheterocyclic compound has been identified in or released from thirteen recorded sources across multiple sectors. Within the energy, oil and gas sector, as well as industrial manufacturing and chemical processing, it is found in lubricants. In the healthcare, pharmaceuticals and veterinary products sector, it is associated with medical devices. Its presence is also recorded in food packaging within the food, food processing and cookware sector. Furthermore, the compound is linked to textiles, leather and furnishings, specifically in synthetic textiles and carpets and rugs. In the electrical and electronic equipment sector, it is found in cell phones, capacitors, wires and cables, batteries, and printed circuit boards, among one other source. Recorded routes of exposure for 4'-Hydroxy-carvedilol include inhalation, oral ingestion, and touch.
Contaminant Type
  • PFAS
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaNot Available
Average Molecular MassNot Available
Monoisotopic MassNot Available
CAS Registry Number1217853-93-4
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C24H26N2O5/c1-29-23-13-16(27)9-10-21(23)30-12-11-25-14-17(28)15-31-22-8-4-7-20-24(22)18-5-2-3-6-19(18)26-20/h2-10,13,17,25-28H,11-12,14-15H2,1H3/t17-/m0/s1
InChI KeyZCJHEORDHXCJNB-KRWDZBQOSA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
SpectraNot Available
Toxicity Profile
Toxicity ValuesNot Available
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Health Effects
Health EffectRelationshipDirectionDescriptionReference
Exposure Sources
Source IDSourceSectorReference
CEDs000007Pesticides?Pesticides are synthetic chemicals designed to prevent, destroy, or control pests that threaten crops and agricultural productivity.Agriculture & land managementNot Available
CEDs000120Wires and cables?Wires and cables are integral components in the transmission of electrical power and signals.Electrical & Electronic EquipmentNot Available
CEDs000121Printed 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 EquipmentNot Available
CEDs000125Batteries?Batteries are devices that store and release electrical energy through electrochemical reactions.Electrical & Electronic EquipmentNot Available
CEDs000130Semiconductors?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 EquipmentNot Available
CEDs000138Lubricants?Lubricants are synthetic or petroleum-derived substances used to reduce friction between surfaces in machinery and equipment, enhancing operational efficiency and longevity.Energy, oil & gasNot Available
CEDs000147Food packaging?Food packaging often utilizes synthetic chemicals, such as plastics and coatings, to enhance durability, moisture resistance, and shelf life.Food, food processing & cookwareNot Available
CEDs000174Lubricants?Lubricants are synthetic or petroleum-based substances used to reduce friction and wear between moving parts in machinery and equipment.Industrial manufacturing & chemical processingNot Available
CEDs000234Medical devices?Medical devices often incorporate synthetic chemicals in their manufacturing processes, which can contribute to contamination in healthcare settings.Healthcare, pharmaceuticals & veterinary productsNot Available
CEDs000451Carpets 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 & furnishingsNot Available
CEDs000454Synthetic 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 & furnishingsNot Available
CEDs000490Personal care & cosmeticsNot Available
CEDs000492Cell phones?Cell phones contain a variety of synthetic chemicals and materials, including plastics, metals, and glass, which can contribute to environmental contamination.Electrical & Electronic EquipmentNot Available
CEDs000493Capacitors?Capacitors are electronic components that store and release electrical energy, often using dielectric materials that can include synthetic chemicals.Electrical & Electronic EquipmentNot Available
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Beta-2 adrenergic receptor structureClick to view 3D structureBeta-2 adrenergic receptorP07550HumansPredicted (SEA)
Prediction Confidence Score
0.694
Applicability Domain
0.839
Statistical Significance
2.00e-05
Supporting Reference Compounds
258
E-value
0.155698
D(2) dopamine receptor structureClick to view 3D structureD(2) dopamine receptorP14416HumansPredicted (SEA)
Prediction Confidence Score
0.648
Applicability Domain
0.839
Statistical Significance
0.0014
Supporting Reference Compounds
1103
E-value
11.2103
Click to view 3D structureBeta-1 adrenergic receptorP34971Mus musculusPredicted (SEA)
Prediction Confidence Score
0.594
Applicability Domain
0.839
Statistical Significance
1.00e-05
Supporting Reference Compounds
13
E-value
0.0778492
Beta-1 adrenergic receptor structureClick to view 3D structureBeta-1 adrenergic receptorP08588HumansPredicted (SEA)
Prediction Confidence Score
0.495
Applicability Domain
0.839
Statistical Significance
6.50e-04
Supporting Reference Compounds
180
E-value
5.0602
Click to view 3D structure5-hydroxytryptamine receptor 1AP19327Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.459
Applicability Domain
0.839
Statistical Significance
0.0072
Supporting Reference Compounds
541
E-value
55.74
Click to view 3D structure5-hydroxytryptamine receptor 1BP28564Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.459
Applicability Domain
0.839
Statistical Significance
0.0011
Supporting Reference Compounds
154
E-value
8.79696
Beta-3 adrenergic receptor structureClick to view 3D structureBeta-3 adrenergic receptorP13945HumansPredicted (SEA)
Prediction Confidence Score
0.458
Applicability Domain
0.839
Statistical Significance
8.30e-04
Supporting Reference Compounds
145
E-value
6.46149
Sodium-dependent serotonin transporter structureClick to view 3D structureSodium-dependent serotonin transporterP31645HumansPredicted (SEA)
Prediction Confidence Score
0.456
Applicability Domain
0.839
Statistical Significance
0.0047
Supporting Reference Compounds
593
E-value
36.2777
Click to view 3D structureBeta-1 adrenergic receptorP18090Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.455
Applicability Domain
0.839
Statistical Significance
2.60e-04
Supporting Reference Compounds
43
E-value
2.02408
D(3) dopamine receptor structureClick to view 3D structureD(3) dopamine receptorP35462HumansPredicted (SEA)
Prediction Confidence Score
0.453
Applicability Domain
0.839
Statistical Significance
0.0085
Supporting Reference Compounds
861
E-value
66.4054
5-hydroxytryptamine receptor 2B structureClick to view 3D structure5-hydroxytryptamine receptor 2BP41595HumansPredicted (SEA)
Prediction Confidence Score
0.453
Applicability Domain
0.839
Statistical Significance
0.0042
Supporting Reference Compounds
686
E-value
32.6967
5-hydroxytryptamine receptor 2C structureClick to view 3D structure5-hydroxytryptamine receptor 2CP28335HumansPredicted (SEA)
Prediction Confidence Score
0.452
Applicability Domain
0.839
Statistical Significance
0.0065
Supporting Reference Compounds
823
E-value
50.9134
5-hydroxytryptamine receptor 2A structureClick to view 3D structure5-hydroxytryptamine receptor 2AP28223HumansPredicted (SEA)
Prediction Confidence Score
0.452
Applicability Domain
0.839
Statistical Significance
0.0095
Supporting Reference Compounds
955
E-value
74.346
5-hydroxytryptamine receptor 6 structureClick to view 3D structure5-hydroxytryptamine receptor 6P50406HumansPredicted (SEA)
Prediction Confidence Score
0.452
Applicability Domain
0.839
Statistical Significance
0.0041
Supporting Reference Compounds
536
E-value
32.1517
Voltage-gated inwardly rectifying potassium channel KCNH2 structureClick to view 3D structureVoltage-gated inwardly rectifying potassium channel KCNH2Q12809HumansPredicted (SEA)
Prediction Confidence Score
0.438
Applicability Domain
0.839
Statistical Significance
0.0159
Supporting Reference Compounds
1498
E-value
123.547
D(1A) dopamine receptor structureClick to view 3D structureD(1A) dopamine receptorP21728HumansPredicted (SEA)
Prediction Confidence Score
0.432
Applicability Domain
0.839
Statistical Significance
0.0055
Supporting Reference Compounds
425
E-value
42.6614
Sodium-dependent dopamine transporter structureClick to view 3D structureSodium-dependent dopamine transporterQ01959HumansPredicted (SEA)
Prediction Confidence Score
0.422
Applicability Domain
0.839
Statistical Significance
0.0041
Supporting Reference Compounds
506
E-value
31.6846
Sodium-dependent noradrenaline transporter structureClick to view 3D structureSodium-dependent noradrenaline transporterP23975HumansPredicted (SEA)
Prediction Confidence Score
0.422
Applicability Domain
0.839
Statistical Significance
0.0035
Supporting Reference Compounds
451
E-value
27.0915
Click to view 3D structureAlpha-1A adrenergic receptorP43140Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.412
Applicability Domain
0.839
Statistical Significance
0.0038
Supporting Reference Compounds
208
E-value
29.972
Click to view 3D structureAlpha-1B adrenergic receptorP15823Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.412
Applicability Domain
0.839
Statistical Significance
0.0014
Supporting Reference Compounds
130
E-value
10.6653
Alpha-2A adrenergic receptor structureClick to view 3D structureAlpha-2A adrenergic receptorP08913HumansPredicted (SEA)
Prediction Confidence Score
0.41
Applicability Domain
0.839
Statistical Significance
0.0047
Supporting Reference Compounds
487
E-value
36.7448
Alpha-2C adrenergic receptor structureClick to view 3D structureAlpha-2C adrenergic receptorP18825HumansPredicted (SEA)
Prediction Confidence Score
0.41
Applicability Domain
0.839
Statistical Significance
0.0039
Supporting Reference Compounds
386
E-value
30.0498
Click to view 3D structureAlpha-1D adrenergic receptorP25100HumansPredicted (SEA)
Prediction Confidence Score
0.408
Applicability Domain
0.839
Statistical Significance
0.0038
Supporting Reference Compounds
258
E-value
29.8163
Alpha-2B adrenergic receptor structureClick to view 3D structureAlpha-2B adrenergic receptorP18089HumansPredicted (SEA)
Prediction Confidence Score
0.377
Applicability Domain
0.839
Statistical Significance
0.0054
Supporting Reference Compounds
340
E-value
41.7272
ATP-dependent translocase ABCB1 structureClick to view 3D structureATP-dependent translocase ABCB1P08183HumansPredicted (SEA)
Prediction Confidence Score
0.374
Applicability Domain
0.839
Statistical Significance
0.0031
Supporting Reference Compounds
139
E-value
24.1333
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available