(5-benzoyl-2,4-dihydroxyphenyl)-phenylmethanone (CED0090147)

Record Information

Version

1.0

Creation Date

2026-08-20 04:40:20 UTC

Update Date

2026-08-20 04:40:20 UTC

SynCED ID

CED0090147

Secondary Accession Numbers

CHEM200221

Identification

Common Name

(5-benzoyl-2,4-dihydroxyphenyl)-phenylmethanone

Class

Small Molecule

Description

(5-benzoyl-2,4-dihydroxyphenyl)-phenylmethanone is an organic compound with the formula C20H14O4 and an average molecular weight of 318.30 g/mol. (5-benzoyl-2,4-dihydroxyphenyl)-phenylmethanone belongs to the linear diarylheptanoids, a subclass of diarylheptanoids within the organic compounds. This compound is categorized under the superclass of phenylpropanoids and polyketides. It has been recorded as being found in or released from electrical and electronic equipment, specifically from power cables and communication cables or conductors.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₂₀H₁₄O₄

Average Molecular Mass

318.300 g/mol

Monoisotopic Mass

318.089 g/mol

CAS Registry Number

Not Available

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C20H14O4/c21-17-12-18(22)16(20(24)14-9-5-2-6-10-14)11-15(17)19(23)13-7-3-1-4-8-13/h1-12,21-22H

InChI Key

GOZHNJTXLALKRL-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

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
2410.0 Log mg/kg [1400:4300]	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
CEDs000510	Communication Cables Or Conductors?Communication cables or conductors are essential components in the transmission of data and signals in various applications, including telecommunications and networking.	Electrical & Electronic Equipment	PubChem
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
CEDs000529	Power Cables?Power cables are used to transmit electrical energy and are typically composed of conductive materials, insulation, and protective coatings.	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
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
CEDs000662	Yarns Or Threads?Yarns or threads used in textiles can be a source of synthetic chemical contamination due to the production processes and treatments they undergo.	Textiles, leather & furnishings	PubChem
CEDs000671	Airplanes And Helicopters?Airplanes and helicopters are significant sources of synthetic chemical contamination primarily through the use of aviation fuels, lubricants, and de-icing agents.	Aviation & Aerospace	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
CEDs000688	Glass Coatings?Glass coatings are synthetic chemical formulations applied to glass surfaces to enhance properties such as durability, UV resistance, and aesthetic appeal.	Building & Construction	PubChem
CEDs000689	Glass Fibres?Glass fibres are composed of fine strands of glass, commonly utilized for their tensile strength and lightweight properties.	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
CEDs000735	Explosives?Explosives are chemical compounds or mixtures designed to undergo rapid decomposition, releasing energy in the form of gas and heat.	Defense & military infrastructure	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
CEDs000740	Paper?Paper production involves the processing of wood fibers and the use of various chemicals, which can lead to synthetic chemical contamination.	Paper, pulp & fiber products	PubChem
CEDs000741	Pigment Pastes?Pigment pastes are concentrated dispersions of pigments used to impart color and properties to materials.	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	Carbonic anhydrase 12	O43570	Humans	Predicted (SEA)	Prediction Confidence Score 0.384 Applicability Domain 0.429 Statistical Significance 0.0071 Supporting Reference Compounds 332 E-value 54.9616
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	Prediction Confidence Score 0.377 Applicability Domain 0.429 Statistical Significance 0.0108 Supporting Reference Compounds 472 E-value 83.9993
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	Prediction Confidence Score 0.377 Applicability Domain 0.429 Statistical Significance 0.0095 Supporting Reference Compounds 407 E-value 74.1903
Click to view 3D structure	HTH-type transcriptional regulator MgrA	P0C1S0	Staphylococcus aureus	Predicted (SEA)	Prediction Confidence Score 0.364 Applicability Domain 0.364 Statistical Significance 1.30e-04 Supporting Reference Compounds 1 E-value 1.01204
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	Prediction Confidence Score 0.355 Applicability Domain 0.4 Statistical Significance 0.012 Supporting Reference Compounds 372 E-value 93.8083
Click to view 3D structure	Cocaine esterase	O00748	Humans	Predicted (SEA)	Prediction Confidence Score 0.355 Applicability Domain 0.44 Statistical Significance 2.90e-04 Supporting Reference Compounds 40 E-value 2.25763
Click to view 3D structure	Streptokinase A	P10520	Streptococcus pyogenes serotype M1	Predicted (SEA)	Prediction Confidence Score 0.347 Applicability Domain 0.436 Statistical Significance 0.0054 Supporting Reference Compounds 425 E-value 42.35
Click to view 3D structure	Nicotinate phosphoribosyltransferase	Q6XQN6	Humans	Predicted (SEA)	Prediction Confidence Score 0.341 Applicability Domain 0.44 Statistical Significance 1.50e-04 Supporting Reference Compounds 12 E-value 1.16774
Click to view 3D structure	Hepatocyte nuclear factor 4-alpha	P41235	Humans	Predicted (SEA)	Prediction Confidence Score 0.341 Applicability Domain 0.394 Statistical Significance 2.00e-04 Supporting Reference Compounds 37 E-value 1.55698
Click to view 3D structure	Carbonic anhydrase 6	P23280	Humans	Predicted (SEA)	Prediction Confidence Score 0.34 Applicability Domain 0.4 Statistical Significance 0.0053 Supporting Reference Compounds 151 E-value 41.1822
Click to view 3D structure	Liver carboxylesterase 1	P12337	Oryctolagus cuniculus	Predicted (SEA)	Prediction Confidence Score 0.338 Applicability Domain 0.44 Statistical Significance 6.00e-05 Supporting Reference Compounds 9 E-value 0.467095
Click to view 3D structure	Sortase A	Q8CM62	Streptococcus mutans	Predicted (SEA)	Prediction Confidence Score 0.333 Applicability Domain 0.333 Statistical Significance 0.0011 Supporting Reference Compounds 1 E-value 8.56341
Click to view 3D structure	Replicase polyprotein 1ab	P0DTD1	SARS-CoV-2	Predicted (SEA)	Prediction Confidence Score 0.332 Applicability Domain 0.394 Statistical Significance 0.01 Supporting Reference Compounds 215 E-value 77.5378
Click to view 3D structure	Histone deacetylase 1	Q13547	Humans	Predicted (SEA)	Prediction Confidence Score 0.332 Applicability Domain 0.394 Statistical Significance 0.0332 Supporting Reference Compounds 497 E-value 258.771
Click to view 3D structure	Prostaglandin G/H synthase 2	P35354	Humans	Predicted (SEA)	Prediction Confidence Score 0.331 Applicability Domain 0.389 Statistical Significance 0.0077 Supporting Reference Compounds 201 E-value 60.2553
Click to view 3D structure	Luciferin 4-monooxygenase	P08659	Photinus pyralis	Predicted (SEA)	Prediction Confidence Score 0.329 Applicability Domain 0.436 Statistical Significance 0.0038 Supporting Reference Compounds 114 E-value 29.5827
Click to view 3D structure	Carbonic anhydrase 7	P43166	Humans	Predicted (SEA)	Prediction Confidence Score 0.326 Applicability Domain 0.367 Statistical Significance 0.0124 Supporting Reference Compounds 242 E-value 96.3773
Click to view 3D structure	Carbonic anhydrase 14	Q9ULX7	Humans	Predicted (SEA)	Prediction Confidence Score 0.326 Applicability Domain 0.367 Statistical Significance 0.0092 Supporting Reference Compounds 172 E-value 71.8548
Click to view 3D structure	Carbonic anhydrase 4	P22748	Humans	Predicted (SEA)	Prediction Confidence Score 0.326 Applicability Domain 0.367 Statistical Significance 0.0087 Supporting Reference Compounds 193 E-value 67.4174
Click to view 3D structure	Liver carboxylesterase 1	P23141	Humans	Predicted (SEA)	Prediction Confidence Score 0.32 Applicability Domain 0.44 Statistical Significance 0.0019 Supporting Reference Compounds 55 E-value 14.7914
Click to view 3D structure	Carbonic anhydrase	Q2PCB5	Dicentrarchus labrax	Predicted (SEA)	Prediction Confidence Score 0.318 Applicability Domain 0.367 Statistical Significance 1.50e-04 Supporting Reference Compounds 9 E-value 1.16774
Click to view 3D structure	Prostaglandin G/H synthase 1	P23219	Humans	Predicted (SEA)	Prediction Confidence Score 0.317 Applicability Domain 0.389 Statistical Significance 0.0066 Supporting Reference Compounds 136 E-value 51.6919
Click to view 3D structure	Carbonic anhydrase 15	Q99N23	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.317 Applicability Domain 0.429 Statistical Significance 0.0058 Supporting Reference Compounds 78 E-value 44.8412
Click to view 3D structure	Aminodeoxyfutalosine synthase	Q5SK48	Thermus thermophilus (strain HB8 / ATCC 27634 / DSM 579)	Predicted (SEA)	Prediction Confidence Score 0.316 Applicability Domain 0.316 Statistical Significance 5.20e-04 Supporting Reference Compounds 1 E-value 4.04816
Click to view 3D structure	Prostaglandin G/H synthase 1	P05979	Ovis aries	Predicted (SEA)	Prediction Confidence Score 0.315 Applicability Domain 0.389 Statistical Significance 0.0042 Supporting Reference Compounds 106 E-value 33.0081