[(z)-undec-7-enyl] acetate (CED0134932)

Record Information
Version1.0
Creation Date2026-08-19 02:52:16 UTC
Update Date2026-08-19 02:52:16 UTC
SynCED IDCED0134932
Secondary Accession Numbers
  • CHEM175483
Identification
Common Name[(z)-undec-7-enyl] acetate
ClassSmall Molecule
Description
[(z)-undec-7-enyl] acetate belongs to the fatty alcohol esters, a subclass of fatty acyls within the organic compounds. This lipid and lipid-like molecule has the chemical formula C13H24O2 and an average molecular weight of 212.33 g/mol.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC13H24O2
Average Molecular Mass212.330 g/mol
Monoisotopic Mass212.178 g/mol
CAS Registry NumberNot Available
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C13H24O2/c1-3-4-5-6-7-8-9-10-11-12-15-13(2)14/h5-6H,3-4,7-12H2,1-2H3/b6-5-
InChI KeyBRPOZIBCZYYKOQ-WAYWQWQTSA-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
5367.0 Log mg/kg [3000:9500]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
CEDs000010Insecticides?Insecticides are synthetic chemicals designed to control or eliminate insect pests that threaten crops and other agricultural products.Agriculture & land managementPubChem
CEDs000597Chemosterilants?Chemosterilants are synthetic chemicals designed to induce sterility in target pest populations, thereby controlling their reproduction and mitigating damage to crops.Agriculture & land managementPubChem
CEDs000600Herbicides And Algicides?Herbicides and algicides are synthetic chemicals primarily used to control unwanted plants and algae in various environments.Agriculture & land managementPubChem
CEDs000604Pest Attractants?Pest attractants are synthetic chemicals designed to lure specific pests for monitoring or control purposes.Agriculture & land managementPubChem
CEDs000605Pest Repellants?Pest repellents, often formulated from synthetic chemicals, are widely used to protect crops from insect infestations and other pests.Agriculture & land managementPubChem
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureCannabinoid receptor 1P20272Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.375
Applicability Domain
0.441
Statistical Significance
0.0028
Supporting Reference Compounds
83
E-value
21.4864
Click to view 3D structureLysophosphatidic acid receptor 3Q9UBY5HumansPredicted (SEA)
Prediction Confidence Score
0.368
Applicability Domain
0.472
Statistical Significance
4.70e-04
Supporting Reference Compounds
21
E-value
3.65891
Click to view 3D structureEsteraseA3QR02Chilo suppressalisPredicted (SEA)
Prediction Confidence Score
0.359
Applicability Domain
0.359
Statistical Significance
1.40e-04
Supporting Reference Compounds
1
E-value
1.08989
Click to view 3D structureLysophosphatidic acid receptor 4Q8BLG2Mus musculusPredicted (SEA)
Prediction Confidence Score
0.354
Applicability Domain
0.354
Statistical Significance
4.00e-04
Supporting Reference Compounds
1
E-value
3.11397
Lysophosphatidic acid receptor 2 structureClick to view 3D structureLysophosphatidic acid receptor 2Q9HBW0HumansPredicted (SEA)
Prediction Confidence Score
0.354
Applicability Domain
0.472
Statistical Significance
4.60e-04
Supporting Reference Compounds
30
E-value
3.58106
Click to view 3D structureFatty-acid amide hydrolase 1O00519HumansPredicted (SEA)
Prediction Confidence Score
0.353
Applicability Domain
0.441
Statistical Significance
0.0047
Supporting Reference Compounds
106
E-value
36.3556
Fatty-acid amide hydrolase 1 structureClick to view 3D structureFatty-acid amide hydrolase 1P97612Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.347
Applicability Domain
0.378
Statistical Significance
0.0034
Supporting Reference Compounds
102
E-value
26.5466
Lysophosphatidic acid receptor 1 structureClick to view 3D structureLysophosphatidic acid receptor 1Q92633HumansPredicted (SEA)
Prediction Confidence Score
0.346
Applicability Domain
0.472
Statistical Significance
6.90e-04
Supporting Reference Compounds
31
E-value
5.3716
Transient receptor potential cation channel subfamily V member 1 structureClick to view 3D structureTransient receptor potential cation channel subfamily V member 1Q8NER1HumansPredicted (SEA)
Prediction Confidence Score
0.344
Applicability Domain
0.366
Statistical Significance
0.0037
Supporting Reference Compounds
104
E-value
29.1935
Cannabinoid receptor 1 structureClick to view 3D structureCannabinoid receptor 1P21554HumansPredicted (SEA)
Prediction Confidence Score
0.343
Applicability Domain
0.366
Statistical Significance
0.0068
Supporting Reference Compounds
200
E-value
52.7039
Cannabinoid receptor 2 structureClick to view 3D structureCannabinoid receptor 2P34972HumansPredicted (SEA)
Prediction Confidence Score
0.338
Applicability Domain
0.366
Statistical Significance
0.0064
Supporting Reference Compounds
175
E-value
50.2127
Tyrosine-protein phosphatase non-receptor type 1 structureClick to view 3D structureTyrosine-protein phosphatase non-receptor type 1P18031HumansPredicted (SEA)
Prediction Confidence Score
0.335
Applicability Domain
0.441
Statistical Significance
0.0044
Supporting Reference Compounds
197
E-value
34.5651
Fatty acid-binding protein, adipocyte structureClick to view 3D structureFatty acid-binding protein, adipocyteP15090HumansPredicted (SEA)
Prediction Confidence Score
0.322
Applicability Domain
0.441
Statistical Significance
8.90e-04
Supporting Reference Compounds
19
E-value
6.92858
Click to view 3D structureCannabinoid receptor 2P47936Mus musculusPredicted (SEA)
Prediction Confidence Score
0.318
Applicability Domain
0.341
Statistical Significance
0.0026
Supporting Reference Compounds
39
E-value
20.3965
Click to view 3D structureCannabinoid receptor 1P47746Mus musculusPredicted (SEA)
Prediction Confidence Score
0.311
Applicability Domain
0.318
Statistical Significance
0.0024
Supporting Reference Compounds
42
E-value
18.9952
Click to view 3D structureCannabinoid receptor 2Q9QZN9Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.307
Applicability Domain
0.341
Statistical Significance
8.40e-04
Supporting Reference Compounds
20
E-value
6.53933
Autotaxin structureClick to view 3D structureAutotaxinQ13822HumansPredicted (SEA)
Prediction Confidence Score
0.305
Applicability Domain
0.354
Statistical Significance
0.0015
Supporting Reference Compounds
40
E-value
11.9109
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1 structureClick to view 3D structure1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1P08487Bos taurusPredicted (SEA)
Prediction Confidence Score
0.305
Applicability Domain
0.313
Statistical Significance
8.00e-04
Supporting Reference Compounds
3
E-value
6.22794
Free fatty acid receptor 4 structureClick to view 3D structureFree fatty acid receptor 4Q5NUL3HumansPredicted (SEA)
Prediction Confidence Score
0.304
Applicability Domain
0.405
Statistical Significance
0.0048
Supporting Reference Compounds
63
E-value
37.679
Putative P2Y purinoceptor 10 structureClick to view 3D structurePutative P2Y purinoceptor 10O00398HumansPredicted (SEA)
Prediction Confidence Score
0.303
Applicability Domain
0.352
Statistical Significance
6.30e-04
Supporting Reference Compounds
10
E-value
4.9045
Free fatty acid receptor 1 structureClick to view 3D structureFree fatty acid receptor 1O14842HumansPredicted (SEA)
Prediction Confidence Score
0.295
Applicability Domain
0.405
Statistical Significance
0.0087
Supporting Reference Compounds
56
E-value
67.4953
Peroxisome proliferator-activated receptor gamma structureClick to view 3D structurePeroxisome proliferator-activated receptor gammaP37231HumansPredicted (SEA)
Prediction Confidence Score
0.414
Applicability Domain
0.441
Statistical Significance
0.0027
Supporting Reference Compounds
192
E-value
20.8636
Peroxisome proliferator-activated receptor alpha structureClick to view 3D structurePeroxisome proliferator-activated receptor alphaQ07869HumansPredicted (SEA)
Prediction Confidence Score
0.414
Applicability Domain
0.441
Statistical Significance
0.0023
Supporting Reference Compounds
127
E-value
17.9053
Peroxisome proliferator-activated receptor delta structureClick to view 3D structurePeroxisome proliferator-activated receptor deltaQ03181HumansPredicted (SEA)
Prediction Confidence Score
0.414
Applicability Domain
0.441
Statistical Significance
0.0016
Supporting Reference Compounds
89
E-value
12.3002
Transient receptor potential cation channel subfamily V member 2 structureClick to view 3D structureTransient receptor potential cation channel subfamily V member 2Q9WUD2Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.393
Applicability Domain
0.441
Statistical Significance
9.50e-04
Supporting Reference Compounds
21
E-value
7.39568
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available