Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.
In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.
Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.
Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.
General Information |
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Catalog: BLP-012571 |
CAS: 1216984-85-8 |
Molecular Formula: C22H19D6N5O2 |
Molecular Weight: 397.50 |
Chemical Structure |
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Description | Rizatriptan-[d6] Benzoate is the labelled analogue of Rizatriptan benzoate. Rizatriptan is a serotonin 5-HT1 receptor agonist ("triptan"). It works by narrowing dilated blood vessels in the brain, relieving migraine headaches. |
Synonyms | Rizatriptan D6 Benzoate; Benzoic acid-N,N-bis[(2H3)methyl]-2-{5-[(1H-1,2,4-triazol-1-yl)methyl]-1H-indol-3-yl}ethan-1-amine |
IUPAC Name | benzoic acid;2-[5-(1,2,4-triazol-1-ylmethyl)-1H-indol-3-yl]-N,N-bis(trideuteriomethyl)ethanamine |
Related CAS | 145202-66-0 (unlabelled) |
Isomeric SMILES | [2H]C([2H])([2H])N(CCC1=CNC2=C1C=C(C=C2)CN3C=NC=N3)C([2H])([2H])[2H].C1=CC=C(C=C1)C(=O)O |
Canonical SMILES | CN(C)CCC1=CNC2=C1C=C(C=C2)CN3C=NC=N3.C1=CC=C(C=C1)C(=O)O |
InChI | InChI=1S/C15H19N5.C7H6O2/c1-19(2)6-5-13-8-17-15-4-3-12(7-14(13)15)9-20-11-16-10-18-20;8-7(9)6-4-2-1-3-5-6/h3-4,7-8,10-11,17H,5-6,9H2,1-2H3;1-5H,(H,8,9)/i1D3,2D3; |
InChI Key | JPRXYLQNJJVCMZ-TXHXQZCNSA-N |
Melting Point | 171-174°C |
Purity | 95% by HPLC; 95% atom D |
Solubility | Soluble in DMSO, Methanol |
Appearance | Off-white to Pale-Yellow Solid |
Storage | Store at -20°C |
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