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-005924 |
CAS: 1215071-08-1 |
Molecular Formula: C6H5D4N3O4 |
Molecular Weight: 191.18 |
Chemical Structure |
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Description | Hydroxy Metronidazole-[d4] is a labelled analogue of Metronidazole. Metronidazole is a genotoxic, carcinogenic and mutagenic drug, belonging to the class of nitroimidazoles, used as a broad spectrum veterinary drug for the treatment and prevention of certain bacterial and protozoal diseases in farm animals. |
Synonyms | 2-(Hydroxymethyl)-5-nitro-1H-imidazole-1-ethanol; Metronidazole-OH-d4; 1-(2-Hydroxyethyl)-2-(hydroxymethyl)-5-nitroimidazole-d4; Hydroxymetronidazole-d4; Hydroxy Metronidazole D4 |
IUPAC Name | 1,1,2,2-tetradeuterio-2-[2-(hydroxymethyl)-5-nitroimidazol-1-yl]ethanol |
Related CAS | 4812-40-2 (unlabelled) |
Isomeric SMILES | [2H]C([2H])(C([2H])([2H])O)N1C(=CN=C1CO)[N+](=O)[O-] |
Canonical SMILES | C1=C(N(C(=N1)CO)CCO)[N+](=O)[O-] |
InChI | InChI=1S/C6H9N3O4/c10-2-1-8-5(4-11)7-3-6(8)9(12)13/h3,10-11H,1-2,4H2/i1D2,2D2 |
InChI Key | AEHPOYAOLCAMIU-LNLMKGTHSA-N |
Melting Point | 118-120°C |
Purity | 95% by CP; 95% atom D |
Solubility | Slightly soluble in Methanol, DMSO |
Appearance | Off-white Solid |
Storage | Store at -20°C |
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