(4-methyl-2-oxochromen-7-yl) dihydrogen phosphate (CED0051591)

Record Information

Version

1.0

Creation Date

2026-08-18 07:14:31 UTC

Update Date

2026-08-18 07:14:31 UTC

Accession Number

CHEM153397

Identification

Common Name

(4-methyl-2-oxochromen-7-yl) dihydrogen phosphate

Class

Small Molecule

Description

(4-methyl-2-oxochromen-7-yl) dihydrogen phosphate belongs to the coumarins and derivatives, a class of phenylpropanoids and polyketides within the organic compounds. This compound has the chemical formula C10H9O6P and an average molecular weight of 256.15 g/mol. It has been found in or released from three recorded sources, specifically electrical and electronic equipment including television systems, line transmission systems, and antennas.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₁₀H₉O₆P

Average Molecular Mass

256.150 g/mol

Monoisotopic Mass

256.014 g/mol

CAS Registry Number

Not Available

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C10H9O6P/c1-6-4-10(11)15-9-5-7(2-3-8(6)9)16-17(12,13)14/h2-5H,1H3,(H2,12,13,14)

InChI Key

BCHIXGBGRHLSBE-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

Spectrum Type	Description	Splash Key	Deposition Date	View
Predicted GC-MS	Predicted GC-MS Spectrum	splash10-0571-3890000000-729a8d6a8a3530f56524	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0a4i-0090000000-eee7442828ef70a8de15	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0a4i-0190000000-29739e501b3fcd36ca97	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-017j-3910000000-fd0b6229fa7803b941d7	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-0a6r-5090000000-0e65e5c7c52bd826062f	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-004i-9030000000-fe59b48209f68ee977f2	Not Available	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum	splash10-004i-9000000000-a5e502a2627af2048a1f	Not Available	View Spectrum

Toxicity Profile

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Toxicity Values

Toxicity Value	Unit	Value Range	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Reference
248.0	Log mg/kg	[140:440]	Rat	LD50	oral	predicted	Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
506	Antennas	Electrical & Electronic Equipment	Not Available
525	Line Transmission Systems	Electrical & Electronic Equipment	Not Available
537	Television Systems	Electrical & Electronic Equipment	Not Available

Pathways

0 pathways

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)	12.3002
Click to view 3D structure	Cholinesterase	P81908	Equus caballus	Predicted (SEA)	20.0072
Click to view 3D structure	Amine oxidase [flavin-containing] B	P27338	Humans	Predicted (SEA)	20.7857
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	21.6421
Click to view 3D structure	Amine oxidase [flavin-containing] A	P21397	Humans	Predicted (SEA)	14.48
Click to view 3D structure	Amine oxidase [flavin-containing] B	P19643	Rattus norvegicus	Predicted (SEA)	6.15009
Click to view 3D structure	Carbonic anhydrase 5A, mitochondrial	P35218	Humans	Predicted (SEA)	18.2946
Click to view 3D structure	Acetylcholinesterase	P22303	Humans	Predicted (SEA)	64.8484
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	57.5306
Click to view 3D structure	Acetylcholinesterase	O42275	Electrophorus electricus	Predicted (SEA)	49.1229
Click to view 3D structure	Amine oxidase [flavin-containing] A	P21396	Rattus norvegicus	Predicted (SEA)	9.49761
Click to view 3D structure	Carbonic anhydrase 7	P43166	Humans	Predicted (SEA)	39.8588
Click to view 3D structure	Carbonic anhydrase 14	Q9ULX7	Humans	Predicted (SEA)	29.8941
Click to view 3D structure	Carbonic anhydrase 5B, mitochondrial	Q9Y2D0	Humans	Predicted (SEA)	29.1935
Click to view 3D structure	Carbonic anhydrase 13	Q9D6N1	Mus musculus	Predicted (SEA)	13.4679
Click to view 3D structure	Carbonic anhydrase 4	P22748	Humans	Predicted (SEA)	36.9005
Click to view 3D structure	Carbonic anhydrase 15	Q99N23	Mus musculus	Predicted (SEA)	18.4503
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	134.446
Click to view 3D structure	Carbonic anhydrase 3	P07451	Humans	Predicted (SEA)	11.6774
Click to view 3D structure	Carbonic anhydrase 6	P23280	Humans	Predicted (SEA)	46.5538
Click to view 3D structure	Androgen receptor	P10275	Humans	Predicted (SEA)	43.362
Click to view 3D structure	5-hydroxytryptamine receptor 2A	P14842	Rattus norvegicus	Predicted (SEA)	183.646
Click to view 3D structure	D(2) dopamine receptor	P61169	Rat	Predicted (SEA)	265.622
Click to view 3D structure	17-beta-hydroxysteroid dehydrogenase type 3	P37058	Humans	Predicted (SEA)	1.86838
Click to view 3D structure	Cytochrome P450 3A4	P08684	Humans	Predicted (SEA)	757.006