Molecular Formula: C27H41F3N2O9S;

Related CAS #: 851528-79-5 (free base) 928821-40-3 (lysine hydrate)

Synonym: MBX-8025 lysine dihydrate; RWJ-800025; MBX-8025 Lysine; RWJ800025; MBX 8025 Lysine MBX8025 Lysine

Chemical Name: L-lysine compound with (R)-2-(4-((2-ethoxy-3-(4-(trifluoromethyl)phenoxy)propyl)thio)-2-methylphenoxy)acetic acid (1:1) dihydrate

InChi Key: WTKSWPYGZDCUNQ-JZXFCXSPSA-N

InChi Code: InChI=1S/C21H23F3O5S.C6H14N2O2.2H2O/c1-3-27-17(11-28-16-6-4-15(5-7-16)21(22,23)24)13-30-18-8-9-19(14(2)10-18)29-12-20(25)26;7-4-2-1-3-5(8)6(9)10;;/h4-10,17H,3,11-13H2,1-2H3,(H,25,26);5H,1-4,7-8H2,(H,9,10);2*1H2/t17-;5-;;/m10../s1

SMILES Code: CCO[C@@H](CSc1cc(C)c(OCC(O)=O)cc1)COc2ccc(C(F)(F)F)cc2.NCCCC[C@@H](C(O)=O)N.O.O