Type : Organophosphate, Surrogate OP, Nerve Agent G-series, pNP, Derivative of Sarin
Chemical_Nomenclature : 1-[1-fluoropropan-2-yloxy(methyl)phosphoryl]oxy-4-nitrobenzene
Canonical SMILES : CC(CF)OP(=O)(C)OC1=CC=C(C=C1)[N+](=O)[O-]
InChI : InChI=1S\/C10H13FNO5P\/c1-8(7-11)16-18(2,15)17-10-5-3-9(4-6-10)12(13)14\/h3-6,8H,7H2,1-2H3
InChIKey : XQMQWIGOTLYTDW-UHFFFAOYSA-N
Other name(s) : 1-fluoropropan-2-yl 4-nitrophenyl methylphosphonate, 1-[1-fluoropropan-2-yloxy(methyl)phosphoryl]oxy-4-nitrobenzene
MW : 277.19
Formula : C10H13FNO5P
CAS_number :
PubChem : 72706574
UniChem : XQMQWIGOTLYTDW-UHFFFAOYSA-N
Families : IMP-pNP-F ligand of proteins in family
ACHE
Protein :
human-ACHE
Title : The inhibition, reactivation and mechanism of VX-, sarin-, fluoro-VX and fluoro-sarin surrogates following their interaction with HuAChE and HuBuChE - Chao_2018_Chem.Biol.Interact_291_220 |
Author(s) : Chao CK , Balasubramanian N , Gerdes JM , Thompson CM |
Ref : Chemico-Biological Interactions , 291 :220 , 2018 |
PubMedID: 29920286 |