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-004839 |
CAS: 1246819-75-9 |
Molecular Formula: C20H18D4N2O4S.HCl |
Molecular Weight: 426.95 |
Chemical Structure |
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Description | N,N-Didesmethyl Diltiazem-[d4] Hydrochloride is the labelled analogue of N,N-Didesmethyl Diltiazem Hydrochloride, which is a metabolite of Diltiazem. |
Synonyms | N,N-Didesmethyl Diltiazem-d4 Hydrochloride; (2S-cis)-3-(Acetyloxy)-5-(2-aminoethyl)-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one-d4 Monohydrochloride; (2S,3S)-N,N-Didemethyldiltiazem-d4 Hydrochloride |
IUPAC Name | [(2S,3S)-5-(2-amino-1,1,2,2-tetradeuterioethyl)-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate;hydrochloride |
Related CAS | 116050-35-2 (unlabelled) 1246912-07-1 (unlabelled free base) |
Canonical SMILES | CC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN)C3=CC=C(C=C3)OC.Cl |
InChI | InChI=1S/C20H22N2O4S.ClH/c1-13(23)26-18-19(14-7-9-15(25-2)10-8-14)27-17-6-4-3-5-16(17)22(12-11-21)20(18)24;/h3-10,18-19H,11-12,21H2,1-2H3;1H/t18-,19+;/m1./s1/i11D2,12D2; |
InChI Key | AFGVHOBXBDWFNW-TYKXSTGASA-N |
Purity | ≥95% |
Solubility | Slightly soluble in Methanol |
Appearance | Off-white Solid |
Storage | Store at -20°C |
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