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IBMPF

Inhibitor related to Soman and Sarin || SID301660

General

Type : Chemical Warfare Agent,Organophosphate

Chemical_Nomenclature : 2-butylmethylphosphonofluoridate

Canonical SMILES : CCC(C)OP(=O)(C)F

InChI : InChI=1S\/C5H12FO2P\/c1-4-5(2)8-9(3,6)7\/h5H,4H2,1-3H3

InChIKey : INIUKZAEJHEEFF-UHFFFAOYSA-N

Other name(s) : S-Butyl methylphosphonofluoridate,2-Butyl methylphosphonofluoridate,Sec-butyl methylphosphonofluoridate,Sec-butyl methylphosphonofluoridoate,1-Methylpropyl methylphosphonofluoridate,352-52-3,2-butylmethylphosphonofluoridate

MW : 154.12

Formula : C5H12FO2P

CAS_number : 352-52-3

PubChem : 520723

UniChem : INIUKZAEJHEEFF-UHFFFAOYSA-N

Target

Families : IBMPF ligand of proteins in family
ACHE BCHE

References (2)

Title : Inhalation toxicokinetics of soman stereoisomers in the atropinized guinea pig with nose-only exposure to soman vapor - Langenberg_1998_Toxicol.Appl.Pharmacol_151_79
Author(s) : Langenberg JP , Spruit HE , van der Wiel HJ , Trap HC , Helmich RB , Bergers WW , van Helden HP , Benschop HP
Ref : Toxicol Appl Pharmacol , 151 :79 , 1998
Abstract : Langenberg_1998_Toxicol.Appl.Pharmacol_151_79
ESTHER : Langenberg_1998_Toxicol.Appl.Pharmacol_151_79
PubMedSearch : Langenberg_1998_Toxicol.Appl.Pharmacol_151_79
PubMedID: 9705889

Title : Toxicokinetics of soman stereoisomers after subcutaneous administration to atropinized guinea pigs - Due_1994_Arch.Toxicol_68_60
Author(s) : Due AH , Trap HC , Langenberg JP , Benschop HP
Ref : Archives of Toxicology , 68 :60 , 1994
Abstract : Due_1994_Arch.Toxicol_68_60
ESTHER : Due_1994_Arch.Toxicol_68_60
PubMedSearch : Due_1994_Arch.Toxicol_68_60
PubMedID: 8166606 
Array
(
    [id] => 4578
    [inhibitor] => IBMPF
    [type] => Array
        (
            [0] => Chemical Warfare Agent
            [1] => Organophosphate
        )

    [other_name] => Array
        (
            [0] => S-Butyl methylphosphonofluoridate
            [1] => 2-Butyl methylphosphonofluoridate
            [2] => Sec-butyl methylphosphonofluoridate
            [3] => Sec-butyl methylphosphonofluoridoate
            [4] => 1-Methylpropyl methylphosphonofluoridate
            [5] => 352-52-3
            [6] => 2-butylmethylphosphonofluoridate
        )

    [chemical_nomenclature] => 2-butylmethylphosphonofluoridate
    [formula] => C5H12FO2P
    [cas_number] => 352-52-3
    [mw] => 154.12
    [pick_me_to_call] => display_script
    [kinetic_parameter] => 
    [paper] => Langenberg_1998_Toxicol.Appl.Pharmacol_151_79 || Due_1994_Arch.Toxicol_68_60
    [comment] => Inhibitor related to Soman and Sarin || SID301660
    [gene_locus] => 
    [kin_inhibitor] => 
    [cid] => 520723
    [family] => ACHE || BCHE
    [inchikey] => INIUKZAEJHEEFF-UHFFFAOYSA-N
    [canonicalsmiles] => CCC(C)OP(=O)(C)F
    [inchi] => InChI=1S\/C5H12FO2P\/c1-4-5(2)8-9(3,6)7\/h5H,4H2,1-3H3
    [wikipedia] => 
    [iupharlig] => 
    [structure] => 
    [substrate] => 
    [interact_gene_locus] => 
    [mutation] => 
    [comment2] => 
    [extoxnet] => 
    [news] => 
    [theoretical_model] => 
)