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N-phosphono-(S)-3-aminopiperidine-2-one-based-A1INH

Adduct covalently linked to active serine

General

Type : Sulfur Compound, Organophosphate, Piperidine, Delta-lactam

Chemical_Nomenclature : ethoxy-[2-(4-pentylphenyl)sulfanylethyl]phosphinous acid

Canonical SMILES : CCCCCc1ccc(cc1)SCC[P@](O)OCC

InChI : InChI=1S\/C15H25O2PS\/c1-3-5-6-7-14-8-10-15(11-9-14)19-13-12-18(16)17-4-2\/h8-11,16H,3-7,12-13H2,1-2H3\/t18-\/m1\/s1

InChIKey : FXKUIYATLFLECN-GOSISDBHSA-N

Other name(s) : A1INH

MW : 300.397

Formula : C15H25O2PS

CAS_number :

PubChem :

UniChem : FXKUIYATLFLECN-GOSISDBHSA-N

Target

Families : N-phosphono-(S)-3-aminopiperidine-2-one-based-A1INH ligand of proteins in family
DPP4N_Peptidase_S9

Structure :
9GOD

Protein :
human-DPP9

References (1)

Title : Sulphostin-inspired N-phosphonopiperidones as selective covalent DPP8 and DPP9 inhibitors - Sewald_2025_Nat.Commun_16_3208
Author(s) : Sewald L , Tabak WWA , Fehr L , Zolg S , Najdzion M , Verhoef CJA , Podlesainski D , Geiss-Friedlander R , Lammens A , Kaschani F , Hellerschmied D , Huber R , Kaiser M
Ref : Nat Commun , 16 :3208 , 2025
Abstract :
PubMedSearch : Sewald_2025_Nat.Commun_16_3208
PubMedID: 40180908
Gene_locus related to this paper: human-DPP4 , human-DPP8 , human-DPP9