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Application Area
Environmental
Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

Clinical diagnostic
Clinical diagnostic

In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.

Organic Chemistry
Organic Chemistry

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.

Metabolic Research
Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

17-Desacetyl Norgestimate-[d6]

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General Information
Catalog: BLP-012907
CAS: 1263184-13-9
Molecular Formula: C21H23D6NO2
Molecular Weight: 333.51
Chemical Structure
17-Desacetyl Norgestimate-[d6]
Description 17-Desacetyl Norgestimate-[d6] is the labelled analogue of 17-Desacetyl Norgestimate, which is a metabolite of Norgestimate.
Synonyms 17-Desacetyl Norgestimate-d6; (17α)-13-Ethyl-17-hydroxy-18,19-dinorpregn-4-en-20-yn-3-one-d6 Oxime; 17-Deacetylnorgestimate-d6; 18-Methylnorethindrone-d6 Oxime; D-Norgestrel-d6 3-Oxime; Levonorgestrel-d6 3-Oxime; RWJ 10553-d6; Norelgestromin-d6
IUPAC Name (3E,8R,9S,10R,13S,14S,17R)-2,2,4,6,6,10-hexadeuterio-13-ethyl-17-ethynyl-3-hydroxyimino-7,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-17-ol
Related CAS 53016-31-2 (unlabelled)
Canonical SMILES CCC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=NO)CCC34
InChI InChI=1S/C21H29NO2/c1-3-20-11-9-17-16-8-6-15(22-24)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23-24H,3,5-12H2,1H3/b22-15+/t16-,17+,18+,19-,20-,21-/m0/s1/i5D2,6D2,13D,16D
InChI Key ISHXLNHNDMZNMC-LLWUDOGESA-N
Melting Point 182-186°C (dec.)
Purity ≥96% by HPLC; ≥98% atom D
Solubility Soluble in Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
Appearance Off-White Solid
Storage Store at -20°C
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