2-[[methyl(oxiran-2-ylmethoxy)phosphoryl]oxymethyl]oxirane (CED0311905)

Record Information
Version1.0
Creation Date2026-09-01 10:48:34 UTC
Update Date2026-09-01 10:48:34 UTC
SynCED IDCED0311905
Secondary Accession Numbers
  • CHEM357690
Identification
Common Name2-[[methyl(oxiran-2-ylmethoxy)phosphoryl]oxymethyl]oxirane
ClassSmall Molecule
Description
2-[[methyl(oxiran-2-ylmethoxy)phosphoryl]oxymethyl]oxirane is a chemical compound with the formula C7H13O5P. It has an average molecular weight of 208.15 g/mol.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC7H13O5P
Average Molecular MassNot Available
Monoisotopic Mass208.050 g/mol
CAS Registry Number77375-34-9
IUPAC NameNot Available
Traditional NameNot Available
SMILESCP(=O)(OCC1CO1)OCC2CO2
InChI IdentifierInChI=1S/C7H13O5P/c1-13(8,11-4-6-2-9-6)12-5-7-3-10-7/h6-7H,2-5H2,1H3
InChI KeyBZVQIZYWIWXTHX-UHFFFAOYSA-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 Values
Toxicity ValueOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalToxicity RatingReference
191.0 Log mg/kg [100:340]RatLD50oralpredictedNot AvailableNot 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
CEDs000652Ropes?Ropes manufactured from synthetic fibers, such as polypropylene, nylon, and polyester, are widely used in various applications, including marine, construction, and outdoor activities.Textiles, leather & furnishingsPubChem
CEDs000696Nanotechnology?Nanotechnology involves the manipulation of materials at the molecular or atomic level, typically within the range of 1 to 100 nanometers.Industrial manufacturing & chemical processingPubChem
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Reverse transcriptase/RNaseH structureClick to view 3D structureReverse transcriptase/RNaseHQ72547Human immunodeficiency virus 1Predicted (SEA)
Prediction Confidence Score
0.194
Applicability Domain
0.203 Low confidence
Statistical Significance
0.1923
Supporting Reference Compounds
79
E-value
1497.2
6-phosphogluconate dehydrogenase, decarboxylating structureClick to view 3D structure6-phosphogluconate dehydrogenase, decarboxylatingP00349Ovis ariesPredicted (SEA)
Prediction Confidence Score
0.191
Applicability Domain
0.227 Low confidence
Statistical Significance
3.90e-04
Supporting Reference Compounds
2
E-value
3.03612
Click to view 3D structureFatty-acid amide hydrolase 1O08914Mus musculusPredicted (SEA)
Prediction Confidence Score
0.191
Applicability Domain
0.289 Low confidence
Statistical Significance
0.2446
Supporting Reference Compounds
46
E-value
1904.43
Thymidylate synthase structureClick to view 3D structureThymidylate synthaseP00469Lactobacillus caseiPredicted (SEA)
Prediction Confidence Score
0.189
Applicability Domain
0.226 Low confidence
Statistical Significance
0.0627
Supporting Reference Compounds
33
E-value
487.881
Muscarinic acetylcholine receptor M4 structureClick to view 3D structureMuscarinic acetylcholine receptor M4P08173HumansPredicted (SEA)
Prediction Confidence Score
0.186
Applicability Domain
0.265 Low confidence
Statistical Significance
0.7562
Supporting Reference Compounds
297
E-value
5887.19
DNA polymerase delta catalytic subunit structureClick to view 3D structureDNA polymerase delta catalytic subunitP28340HumansPredicted (SEA)
Prediction Confidence Score
0.185
Applicability Domain
0.185 Low confidence
Statistical Significance
0.002
Supporting Reference Compounds
1
E-value
15.7255
Fatty-acid amide hydrolase 1 structureClick to view 3D structureFatty-acid amide hydrolase 1P97612Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.184
Applicability Domain
0.295 Low confidence
Statistical Significance
0.5076
Supporting Reference Compounds
102
E-value
3951.86
Inositol 1,4,5-trisphosphate-gated calcium channel ITPR1 structureClick to view 3D structureInositol 1,4,5-trisphosphate-gated calcium channel ITPR1P29994Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.183
Applicability Domain
0.214 Low confidence
Statistical Significance
8.30e-04
Supporting Reference Compounds
2
E-value
6.46149
Muscarinic acetylcholine receptor M2 structureClick to view 3D structureMuscarinic acetylcholine receptor M2P08172HumansPredicted (SEA)
Prediction Confidence Score
0.182
Applicability Domain
0.265 Low confidence
Statistical Significance
0.8627
Supporting Reference Compounds
373
E-value
6716.36
Click to view 3D structureThymidylate synthaseQ2TA32Bos taurusPredicted (SEA)
Prediction Confidence Score
0.178
Applicability Domain
0.189 Low confidence
Statistical Significance
0.003
Supporting Reference Compounds
2
E-value
23.5105
Fructose-bisphosphate aldolase class 2 structureClick to view 3D structureFructose-bisphosphate aldolase class 2P0AB71Escherichia coli (strain K12)Predicted (SEA)
Prediction Confidence Score
0.176
Applicability Domain
0.176 Low confidence
Statistical Significance
0.0023
Supporting Reference Compounds
1
E-value
17.7496
Fructose-bisphosphate aldolase A structureClick to view 3D structureFructose-bisphosphate aldolase AP00883Oryctolagus cuniculusPredicted (SEA)
Prediction Confidence Score
0.176
Applicability Domain
0.176 Low confidence
Statistical Significance
5.80e-04
Supporting Reference Compounds
2
E-value
4.51525
Thymidylate synthase ThyA structureClick to view 3D structureThymidylate synthase ThyAP9WFR9Mycobacterium tuberculosisPredicted (SEA)
Prediction Confidence Score
0.175
Applicability Domain
0.175 Low confidence
Statistical Significance
0.0037
Supporting Reference Compounds
1
E-value
28.8821
Triosephosphate isomerase structureClick to view 3D structureTriosephosphate isomeraseP00939Oryctolagus cuniculusPredicted (SEA)
Prediction Confidence Score
0.174
Applicability Domain
0.176 Low confidence
Statistical Significance
5.30e-04
Supporting Reference Compounds
2
E-value
4.12601
Acetylcholinesterase structureClick to view 3D structureAcetylcholinesteraseP07140Drosophila melanogasterPredicted (SEA)
Prediction Confidence Score
0.172
Applicability Domain
0.206 Low confidence
Statistical Significance
0.0018
Supporting Reference Compounds
2
E-value
14.0129
6-phosphogluconate dehydrogenase, decarboxylating, putative structureClick to view 3D structure6-phosphogluconate dehydrogenase, decarboxylating, putativeP31072Trypanosoma bruceiPredicted (SEA)
Prediction Confidence Score
0.171
Applicability Domain
0.227 Low confidence
Statistical Significance
7.10e-04
Supporting Reference Compounds
4
E-value
5.52729
Orotidine phosphate decarboxylase structureClick to view 3D structureOrotidine phosphate decarboxylaseQ8T6J6Plasmodium falciparumPredicted (SEA)
Prediction Confidence Score
0.167
Applicability Domain
0.167 Low confidence
Statistical Significance
0.0105
Supporting Reference Compounds
1
E-value
81.7417
Diphosphomevalonate decarboxylase structureClick to view 3D structureDiphosphomevalonate decarboxylaseP53602HumansPredicted (SEA)
Prediction Confidence Score
0.167
Applicability Domain
0.167 Low confidence
Statistical Significance
0.0118
Supporting Reference Compounds
1
E-value
91.9399
Click to view 3D structureP2Y purinoceptor 6Q15077HumansPredicted (SEA)
Prediction Confidence Score
0.166
Applicability Domain
0.186 Low confidence
Statistical Significance
0.1128
Supporting Reference Compounds
38
E-value
878.528
Autotaxin structureClick to view 3D structureAutotaxinQ13822HumansPredicted (SEA)
Prediction Confidence Score
0.329
Applicability Domain
0.333
Statistical Significance
0.0012
Supporting Reference Compounds
40
E-value
9.10836
Click to view 3D structureLysophosphatidic acid receptor 3Q8K5E0Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.315
Applicability Domain
0.333
Statistical Significance
3.00e-05
Supporting Reference Compounds
4
E-value
0.233548
Lysophosphatidic acid receptor 2 structureClick to view 3D structureLysophosphatidic acid receptor 2Q9HBW0HumansPredicted (SEA)
Prediction Confidence Score
0.291
Applicability Domain
0.333
Statistical Significance
0.0014
Supporting Reference Compounds
30
E-value
10.6653
N-acetylglucosamine-6-phosphate deacetylase structureClick to view 3D structureN-acetylglucosamine-6-phosphate deacetylaseQ9Y303HumansPredicted (SEA)
Prediction Confidence Score
0.256
Applicability Domain
0.256 Low confidence
Statistical Significance
4.70e-04
Supporting Reference Compounds
1
E-value
3.65891
Click to view 3D structureLysophosphatidic acid receptor 1P61794Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.213
Applicability Domain
0.333
Statistical Significance
2.20e-04
Supporting Reference Compounds
6
E-value
1.71268
Click to view 3D structure1-deoxy-D-xylulose-5-phosphate synthaseB7UJP3Escherichia coli O127:H6 (strain E2348/69 / EPEC)Predicted (SEA)
Prediction Confidence Score
0.207
Applicability Domain
0.219 Low confidence
Statistical Significance
8.80e-04
Supporting Reference Compounds
2
E-value
6.85073
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available