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-010496 |
CAS: 1093230-99-9 |
Molecular Formula: C19H21D3O2 |
Molecular Weight: 287.41 |
Chemical Structure |
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Description | 3-O-Methyl Estrone-[d3] is the labelled analogue of 3-O-Methyl Estrone, which is a derivative of Estrone. Estrone is one of the three naturally occurring estrogens, the others being estradiol and estriol. |
Synonyms | 3-O-Methyl Estrone D3; 3-(Methoxy-D3)-estra-1,3,5(10)-trien-17-one; 3-Methoxy-estra-1,3,5(10)-trien-17-one-d3; (+)-Estrone 3-Methyl Ether-d3; 3-Methoxyestrone-d3; 3-O-Methylestrone-d3; Estrone O-Methyl Ether-d3; NSC 88911-d3; Oestrone Methyl Ether-d3; Estrone 3-methyl-d3 ether |
IUPAC Name | (8R,9S,13S,14S)-13-methyl-3-(trideuteriomethoxy)-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one |
Related CAS | 1624-62-0 (unlabelled) |
Isomeric SMILES | [2H]C([2H])([2H])OC1=CC2=C(C=C1)[C@H]3CC[C@]4([C@H]([C@@H]3CC2)CCC4=O)C |
Canonical SMILES | CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)OC |
InChI | InChI=1S/C19H24O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h4,6,11,15-17H,3,5,7-10H2,1-2H3/t15-,16-,17+,19+/m1/s1/i2D3 |
InChI Key | BCWWDWHFBMPLFQ-YIJAEARJSA-N |
Purity | >95% |
Solubility | Slightly soluble in Acetonitrile, Chloroform, Ethyl Acetate, Methanol |
Appearance | Dark Brown Solid |
Storage | Store at 2-8°C |
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