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Norgestrel-[d6]

General Information
Catalog: BLP-003581
CAS: 2376035-98-0
Molecular Formula: C21H22D6O2
Molecular Weight: 318.49
Chemical Structure
Norgestrel-[d6]
Description Norgestrel-[d6], is the labelled analogue of Norgestrel. Norgestrel is a progestin that is used in combination with an estrogen in hormonal contraceptives.
Synonyms Norgestrel-d6; 18,19-Dinorpregn-4-en-20-yn-3-one-2,2,4,6,6,10-d6, 13-ethyl-17-hydroxy-, (17α)-
IUPAC Name (8R,9S,10R,13S,14S,17R)-2,2,4,6,6,10-hexadeuterio-13-ethyl-17-ethynyl-17-hydroxy-7,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
Related CAS 797-63-7 (unlabelled) 6533-00-2 (unlabelled)
Canonical SMILES CCC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34
InChI InChI=1S/C21H28O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23H,3,5-12H2,1H3/t16-,17+,18+,19-,20-,21-/m0/s1/i5D2,6D2,13D,16D
InChI Key WWYNJERNGUHSAO-PWFLSJGKSA-N
Melting Point 207-211 °C
Purity 95% by HPLC; 95% atom D
Solubility Soluble in Chloroform, Methanol
Appearance White to Pale Yellow Solid
Storage Store at-20°C

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