M-3-G-D3 HYDRATE

• CAT Number: M107857
• CAS Number: 136765-44-1
• Molecular Formula: C23H27NO9
• Molecular Weight: 464.48
• Purity: ≥95%
• Storage: Store at RT
• IUPAC Name: (2S,3S,4S,5R,6S)-6-[[(4R,4aR,7S,7aR,12bS)-7-hydroxy-3-(trideuteriomethyl)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;hydrate
• InChI: InChI=1S/C23H27NO9.H2O/c1-24-7-6-23-10-3-4-12(25)20(23)32-18-13(5-2-9(14(18)23)8-11(10)24)31-22-17(28)15(26)16(27)19(33-22)21(29)30;/h2-5,10-12,15-17,19-20,22,25-28H,6-8H2,1H3,(H,29,30);1H2/t10-,11+,12-,15-,16-,17+,19-,20-,22+,23-;/m0./s1/i1D3
• InChIKey: ZXXDFTDTRJWDOR-TYFKZZAUSA-N
• SMILES: [2H]C([2H])([2H])N1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O)O[C@H]3[C@H](C=C4)O.O

M-3-G-D3 Hydrate is a deuterated form of the metabolite M-3-G, labeled with three deuterium atoms. This compound is utilized in pharmacokinetic and metabolic studies, particularly for tracking the biotransformation of drugs and endogenous compounds in biological systems. The deuterium labeling enhances the accuracy of mass spectrometric analysis, allowing for precise quantification and differentiation of the compound in complex matrices. M-3-G-D3 Hydrate is a valuable tool for researchers focusing on drug metabolism, toxicology, and the development of novel therapeutics, providing reliable data for the evaluation of metabolic pathways and drug efficacy.