PFI-653

PFI-653 is an inhibitor of the pantetheinase vanin-1 (IC50 = 6.85 nM for the human enzyme). In vivo, PFI-653 (50 mg/kg) prevents reductions in body weight, as well as reduces disease severity and serum vanin-1 levels in a mouse model of colitis induced by dextran sulfate sodium (DSS, Cay-23250). See the Structural Genomics Consortium (SGC) website for more information.Formal Name: 8-oxa-2-azaspiro[4.5]dec-2-yl[2-[(2-pyrazinylmethyl)amino]-5-pyrimidinyl]-methanone. CAS Number: 2173134-00-2. Synonyms: Vanin 1-IN-1, Vanin 1 Inhibitor 1, VNN1-IN-1, VNN1 Inhibitor 1. Molecular Formula: C18H22N6O2. Formula Weight: 354.4. Purity: >98%. Formulation: (Request formulation change), A solid. Solubility: DMSO: Sparingly Soluble: 1-10 mg/ml. SMILES: O=C(N1CC2(CCOCC2)CC1)C3=CN=C(N=C3)NCC4=NC=CN=C4. InChi Code: InChI=1S/C18H22N6O2/c25-16(24-6-1-18(13-24)2-7-26-8-3-18)14-9-21-17(22-10-14)23-12-15-11-19-4-5-20-15/h4-5,9-11H,1-3,6-8,12-13H2,(H,21,22,23). InChi Key: VGRLXWFIXGZRMS-UHFFFAOYSA-N.