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VXS

The 18F on ethyl group derivative is a PET probe C9[18F]H11NO6P [18F]-VXSO-(2-[18F]fluoroethyl)-O-(p-nitrophenyl)methylphosphonate [18F]-VXS. Mouse LD50 intravenous 300 ug/kg (0.3 mg/kg)

General

Type : PET probe,Organophosphate,Derivative of Paraoxon,Derivative of VX,pNP

Chemical_Nomenclature : ethyl methyl (4-nitrophenyl) phosphate

Canonical SMILES : CCOP(=O)(OC)OC1=CC=C(C=C1)[N+](=O)[O-]

InChI : InChI=1S\/C9H12NO6P\/c1-3-15-17(13,14-2)16-9-6-4-8(5-7-9)10(11)12\/h4-7H,3H2,1-2H3

InChIKey : YOMNJRBOMBSLAR-UHFFFAOYSA-N

Other name(s) : Ethyl methyl p-nitrophenyl phosphate,BRN 2145354,H.C. 2071,Phosphoric acid, ethyl methyl p-nitrophenyl ester,DTXSID20907087,LS-107847,Phosphoric acid methylethyl 4-nitrophenyl ester,CHEMBL2115282,CHEMBL2114315

MW : 261.17

Formula : C9H12NO6P

CAS_number : 1021-47-2

PubChem : 120528

UniChem : YOMNJRBOMBSLAR-UHFFFAOYSA-N

Target

Families : VXS ligand of proteins in family
BCHE ACHE

Protein :
human-ACHE

References (2)

Title : Positron emission tomography evaluation of oxime countermeasures in live rats using the tracer O-(2-[(18) F]fluoroethyl)-O-(p-nitrophenyl)methylphosphonate [(18) F]-VXS - Hayes_2020_Ann.N.Y.Acad.Sci__
Author(s) : Hayes TR , Blecha JE , Chao CK , Huynh TL , VanBrocklin HD , Zinn KR , Taylor P , Gerdes JM , Thompson CM
Ref : Annals of the New York Academy of Sciences , : , 2020
Abstract : Hayes_2020_Ann.N.Y.Acad.Sci__
ESTHER : Hayes_2020_Ann.N.Y.Acad.Sci__
PubMedSearch : Hayes_2020_Ann.N.Y.Acad.Sci__
PubMedID: 32436233

Title : [Experimental myotic action of homologous and analogous diethyl-4-nitrophenyl phosphate derivatives] -
Author(s) : Cheymol G , Godefroy F
Ref : Therapie , 20 :743 , 1965
PubMedID: 5840884 
Array
(
    [id] => 2124
    [inhibitor] => VXS
    [type] => Array
        (
            [0] => PET probe
            [1] => Organophosphate
            [2] => Derivative of Paraoxon
            [3] => Derivative of VX
            [4] => pNP
        )

    [other_name] => Array
        (
            [0] => Ethyl methyl p-nitrophenyl phosphate
            [1] => BRN 2145354
            [2] => H.C. 2071
            [3] => Phosphoric acid, ethyl methyl p-nitrophenyl ester
            [4] => DTXSID20907087
            [5] => LS-107847
            [6] => Phosphoric acid methylethyl 4-nitrophenyl ester
            [7] => CHEMBL2115282
            [8] => CHEMBL2114315
        )

    [chemical_nomenclature] => ethyl methyl (4-nitrophenyl) phosphate
    [formula] => C9H12NO6P
    [cas_number] => 1021-47-2
    [mw] => 261.17
    [pick_me_to_call] => display_script
    [kinetic_parameter] => 
    [paper] => Hayes_2020_Ann.N.Y.Acad.Sci__ || Cheymol_1965_Therapie_20_743
    [comment] => The 18F on ethyl group derivative is a PET probe C9[18F]H11NO6P [18F]-VXSO-(2-[18F]fluoroethyl)-O-(p-nitrophenyl)methylphosphonate [18F]-VXS. Mouse LD50 intravenous 300 ug\/kg (0.3 mg\/kg)
    [gene_locus] => human-ACHE
    [kin_inhibitor] => 
    [cid] => 120528
    [family] => BCHE || ACHE
    [inchikey] => YOMNJRBOMBSLAR-UHFFFAOYSA-N
    [canonicalsmiles] => CCOP(=O)(OC)OC1=CC=C(C=C1)[N+](=O)[O-]
    [inchi] => InChI=1S\/C9H12NO6P\/c1-3-15-17(13,14-2)16-9-6-4-8(5-7-9)10(11)12\/h4-7H,3H2,1-2H3
    [wikipedia] => 
    [iupharlig] => 
    [structure] => 
    [substrate] => 
    [interact_gene_locus] => 
    [mutation] => 
    [comment2] => 
    [extoxnet] => 
    [news] => 
    [theoretical_model] => 
)