QUINALPHOS

/static/temp/default.svg Search structure
UNII 26S837727Y
Source Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ...

Structure

InChI Key JYQUHIFYBATCCY-UHFFFAOYSA-N
Smiles CCOP(=S)(OCC)Oc1cnc2ccccc2n1
InChI
InChI=1S/C12H15N2O3PS/c1-3-15-18(19,16-4-2)17-12-9-13-10-7-5-6-8-11(10)14-12/h5-9H,3-4H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H15N2O3PS
Molecular Weight 298.3
AlogP 3.01
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 6.0
Polar Surface Area 95.37
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 19.0
Assay Description Organism Bioactivity Reference
Effect on total amino acids level in Sogatella furcifera-sensitive Oryza sativa (rice) plant ARC6248 leaf blade measured per gram of dry weight at 0.100% concentration (Rvb = 3.54 mg/g fresh wt) Oryza sativa 3.61 mg
Effect on total amino acids level in Sogatella furcifera-resistanct Oryza sativa (rice) plant PR116 leaf blade measured per gram of dry weight at 0.100% concentration (Rvb = 3.91 mg/g fresh wt) Oryza sativa 4.89 mg
Effect on total protein level in Sogatella furcifera-sensitive Oryza sativa (rice) plant ARC6248 leaf blade measured per gram of dry weight at 0.100% concentration (Rvb = 17.67 mg/g fresh wt) Oryza sativa 21.56 mg
Effect on total protein level in Sogatella furcifera-resistanct Oryza sativa (rice) plant PR116 leaf blade measured per gram of dry weight at 0.100% concentration (Rvb = 21.67 mg/g fresh wt) Oryza sativa 22.78 mg
Effect on total phenols level in Sogatella furcifera-sensitive Oryza sativa (rice) plant ARC6248 leaf blade measured per gram of dry weight at 0.100% concentration (Rvb = 17.08 mg/g dry wt) Oryza sativa 17.08 mg
Effect on total phenols level in Sogatella furcifera-resistanct Oryza sativa (rice) plant PR116 leaf blade measured per gram of dry weight at 0.100% concentration (Rvb = 8.08 mg/g dry wt) Oryza sativa 6.75 mg
Effect on reducing sugar level in Sogatella furcifera-sensitive Oryza sativa (rice) plant ARC6248 leaf blade measured per gram of dry weight at 0.100% concentration (Rvb = 8.37 mg/g dry wt) Oryza sativa 10.0 mg
Effect on reducing sugar level in Sogatella furcifera-resistanct Oryza sativa (rice) plant PR116 leaf blade measured per gram of dry weight at 0.100% concentration (Rvb = 9.35 mg/g dry wt) Oryza sativa 13.04 mg
Effect on total sugar level in Sogatella furcifera-sensitive Oryza sativa (rice) plant ARC6248 leaf blade measured per gram of dry weight at 0.100% concentration (Rvb = 34.05 mg/g dry wt) Oryza sativa 38.84 mg
Effect on total sugar level in Sogatella furcifera-resistanct Oryza sativa (rice) plant PR116 leaf blade measured per gram of dry weight at 0.100% concentration (Rvb = 36.16 mg/g dry wt) Oryza sativa 42.05 mg
Effect on total amino acids level in Sogatella furcifera-sensitive Oryza sativa (rice) plant ARC6248 leaf sheath measured per gram of dry weight at 0.100% concentration (Rvb = 2.11 mg/g fresh wt) Oryza sativa 2.38 mg
Effect on total amino acids level in Sogatella furcifera-resistanct Oryza sativa (rice) plant PR116 leaf sheath measured per gram of dry weight at 0.100% concentration (Rvb = 2.58 mg/g fresh wt) Oryza sativa 2.93 mg
Effect on total protein level in Sogatella furcifera-sensitive Oryza sativa (rice) plant ARC6248 leaf sheath measured per gram of dry weight at 0.100% concentration (Rvb = 6.11 mg/g fresh wt) Oryza sativa 7.22 mg
Effect on total protein level in Sogatella furcifera-resistanct Oryza sativa (rice) plant PR116 leaf sheath measured per gram of dry weight at 0.100% concentration (Rvb = 7.06 mg/g fresh wt) Oryza sativa 8.5 mg
Insecticidal activity against Sogatella furcifera on insect-sensitive rice plant ARC6248 assessed as nymphal duration at 0.100% concentration (Rvb = 14.48 days) Sogatella furcifera 14.46 day
Insecticidal activity against Sogatella furcifera on insect-resistanct rice plant PR116 assessed as nymphal duration at 0.100% concentration (Rvb = 11.75 days) Sogatella furcifera 11.65 day
Insecticidal activity against Sogatella furcifera on insect-sensitive rice plant ARC6248 assessed as resurgence ratio at 0.100% concentration Sogatella furcifera 1.13
Insecticidal activity against Sogatella furcifera on insect-resistanct rice plant PR116 assessed as resurgence ratio at 0.100% concentration Sogatella furcifera 1.31
Insecticidal activity against Sogatella furcifera on insect-sensitive rice plant ARC6248 assessed as reproduction at 0.100% concentration Sogatella furcifera None
Insecticidal activity against Sogatella furcifera on insect-resistanct rice plant PR116 assessed as hopper population at 0.100% concentration Sogatella furcifera None
Effect on total phenols level in Sogatella furcifera-sensitive Oryza sativa (rice) plant ARC6248 leaf sheath measured per gram of dry weight at 0.100% concentration (Rvb = 12.75 mg/g dry wt) Oryza sativa 1308.0 mg
Effect on total phenols level in Sogatella furcifera-resistanct Oryza sativa (rice) plant PR116 leaf sheath measured per gram of dry weight at 0.100% concentration (Rvb = 5.75 mg/g dry wt) Oryza sativa 5.67 mg
Effect on reducing sugar level in Sogatella furcifera-sensitive Oryza sativa (rice) plant ARC6248 leaf sheath measured per gram of dry weight at 0.100% concentration (Rvb = 6.41 mg/g dry wt) Oryza sativa 8.8 mg
Effect on reducing sugar level in Sogatella furcifera-resistanct Oryza sativa (rice) plant PR116 leaf sheath measured per gram of dry weight at 0.100% concentration (Rvb = 7.50 mg/g dry wt) Oryza sativa 11.31 mg
Effect on total sugar level in Sogatella furcifera-sensitive Oryza sativa (rice) plant ARC6248 leaf sheath measured per gram of dry weight at 0.100% concentration (Rvb = 25.98 mg/g dry wt) Oryza sativa 31.87 mg
Effect on total sugar level in Sogatella furcifera-resistanct Oryza sativa (rice) plant PR116 leaf sheath measured per gram of dry weight at 0.100% concentration (Rvb = 30.27 mg/g dry wt) Oryza sativa 30.27 mg
Insecticidal activity against Sogatella furcifera on insect-sensitive rice plant ARC6248 assessed as growth index at 0.100% concentration (Rvb = 2.38%) Sogatella furcifera 2.61 %
Insecticidal activity against Sogatella furcifera on insect-resistanct rice plant PR116 assessed as growth index at 0.100% concentration (Rvb = 6.02%) Sogatella furcifera 6.24 %
Insecticidal activity against Sogatella furcifera on insect-sensitive rice plant ARC6248 assessed as nymphal survival at 0.100% concentration (Rvb = 34.17%) Sogatella furcifera 37.5 %
Insecticidal activity against Sogatella furcifera on insect-resistanct rice plant PR116 assessed as nymphal survival at 0.100% concentration (Rvb = 70.28%) Sogatella furcifera 72.22 %
Insecticidal activity against Lepidoptera infected rice plant assessed as increase in grain yield (Rvb = 28%) Lepidoptera 28.0 %
Insecticidal activity against Lepidoptera infected rice plant assessed as white earhead damage (Rvb = 12.17%) Lepidoptera 6.33 %
Insecticidal activity against Lepidoptera infected rice plant assessed as dead heart damage (Rvb = 11.87%) Lepidoptera 4.12 %

Cross References

Resources Reference
ChEMBL CHEMBL1893890
FDA SRS 26S837727Y
PDB WYN
PubChem 26124
SureChEMBL SCHEMBL18079
ZINC ZINC00900717
CONTENTS