3-Des[2-(Dimethylamino)ethyl] Zolmitriptan-d6 3-Acetic Acid

CAS: 251451-31-7

Ref. TR-D288969

Product Information

• Name: 3-Des[2-(Dimethylamino)ethyl] Zolmitriptan-d6 3-Acetic Acid
• Synonyms: 5-[[(4S)-2-Oxo-4-oxazolidinyl]methyl]-1H-indole-3-acetic Acid-d6
• Brand: TRC

Description

Applications Isotope labelled 3-Des[2-(Dimethylamino)ethyl] Zolmitriptan 3-Acetic Acid (D288965), the indole acetic acid metabolite of Zolmitriptan (Z639000) formed by human hepatocytes.
References Wild, M.J. et al.: Xenobiotica, 29, 847 (1999);

Chemical properties

• Molecular weight: 280.309
• Formula: C₁₄D₆H₈N₂O₄
• Color/Form: Neat
• InChI: InChI=1S/C14H14N2O4/c17-13(18)5-9-6-15-12-2-1-8(4-11(9)12)3-10-7-20-14(19)16-10/h1-2,4,6,10,15H,3,5,7H2,(H,16,19)(H,17,18)/t10-/m0/s1/i1D,2D,4D,6D,7D2
• InChI key: InChIKey=HJCHJQORBPQIIJ-XDDDROSWSA-N
• SMILES: [2H]c1[nH]c2c([2H])c([2H])c(C[C@@H]3NC(=O)OC3([2H])[2H])c([2H])c2c1CC(=O)O