CHMP-S-methyl

can be synthetized as (Sp) or (P-) and (Rp) or (P+) stereoisomers

General

Type : Organophosphate, Sulfur Compound

Chemical_Nomenclature : [methyl(methylsulfanyl)phosphoryl]oxycycloheptane

Canonical SMILES : C[P](=O)(OC1CCCCCC1)SC

InChI : InChI=1S\/C9H19O2PS\/c1-12(10,13-2)11-9-7-5-3-4-6-8-9\/h9H,3-8H2,1-2H3

InChIKey : USEOQBTXEQNYJU-UHFFFAOYSA-N

Other name(s) : Cycloheptyl methyl S-methylphosphonylthioate


MW : 222.29

Formula : C9H19O2PS

CAS_number :

PubChem : 85590434

UniChem : USEOQBTXEQNYJU-UHFFFAOYSA-N

Target

Families : CHMP-S-methyl ligand of proteins in family
ACHE

References (3)

Title : Aspartate 74 as a primary determinant in acetylcholinesterase governing specificity to cationic organophosphonates - Hosea_1996_Biochemistry_35_10995
Author(s) : Hosea NA , Radic Z , Tsigelny I , Berman HA , Quinn DM , Taylor P
Ref : Biochemistry , 35 :10995 , 1996
PubMedID: 8718893

Title : Chiral reactions of acetylcholinesterase probed with enantiomeric methylphosphonothioates. Noncovalent determinants of enzyme chirality [published erratum appears in J Biol Chem 1989 Nov 25\;264(33):20154] - Berman_1989_J.Biol.Chem_264_3942
Author(s) : Berman HA , Leonard K
Ref : Journal of Biological Chemistry , 264 :3942 , 1989
PubMedID: 2917983

Title : Chiral nature of covalent methylphosphonyl conjugates of acetylcholinesterase - Berman_1989_J.Biol.Chem_264_3951
Author(s) : Berman HA , Decker MM
Ref : Journal of Biological Chemistry , 264 :3951 , 1989
PubMedID: 2917984