Inhibitor

Bibliography

Biblio print

Tree Display

AceDB Schema

XML Display

Feedback

Inhibitor Report for: Diphenyl-allylphosphonate

General
Type Organophosphate
Chemical_Nomenclature [phenoxy(prop-2-enyl)phosphoryl]oxybenzene
Canonical SMILES C=CCP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2
InChI InChI=1S/C15H15O3P/c1-2-13-19(16,17-14-9-5-3-6-10-14)18-15-11-7-4-8-12-15/h2-12H,1,13H2
InChIKey INDCZXZNLPWHJP-UHFFFAOYSA-N
Other name(s) [ethene(phenoxy)phosphoryl]oxybenzene ; Phosphonic acid, 2-propenyl-, diphenyl ester ; SCHEMBL780979 ; ACMC-20m463 ; CTK0G8438 ; Allylphosphonic acid diphenyl ester
________________________________________________________________________________________________
MW|274.25
Formula|C15H15O3P
CAS_number|101111-39-1
PubChem|11403078
UniChem|INDCZXZNLPWHJP-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | Diphenyl-allylphosphonate ligand of proteins in family: Thioesterase
Stucture | 2 structures: 5D3K, 5D3Z
Protein | sacer-ery3

References:
Search PubMed for references concerning: Diphenyl-allylphosphonate
    Title: Towards a characterization of the structural determinants of specificity in the macrocyclizing thioesterase for deoxyerythronolide B biosynthesis
    Argyropoulos P, Bergeret F, Pardin C, Reimer JM, Pinto A, Boddy CN, Schmeing TM
    Ref: Biochimica & Biophysica Acta, 1860:486, 2016 : PubMed