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2-Methoxyestrone-1,4,16,16-d4

Catalog Number ACM949885909
CAS 949885-90-9
Structure Structure
Synonyms (8R,9S,13S,14S)-1,4,6-Trideuterio-3-deuteriooxy-2-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
IUPAC Name (8R,9S,13S,14S)-1,4,6-trideuterio-3-deuteriooxy-2-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
Molecular Weight 304.42
Molecular Formula C19H20D4O3
InChI InChI=1S/C19H24O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,20H,3-8H2,1-2H3/t12-,13+,15-,19-/m0/s1/i3D,9D,10D/hD/t3?,12-,13+,15-,19-
InChI Key WHEUWNKSCXYKBU-NZTFOOEBSA-N
Purity 99 atom % D
Exact Mass 300.17300
Hazards Non-hazardous for transport.
Isomeric SMILES [2H]C1C[C@@H]2[C@H](CC[C@]3([C@H]2CCC3=O)C)C4=C(C(=C(C(=C14)[2H])O[2H])OC)[2H]
Isotopic Enrichment 99 atom % D
Stability Stable if stored under recommended conditions. After three years, the compound should be re-analyzed for chemical purity before use.
Storage Conditions Store refrigerated
Unlabeled CAS 362-08-3
Unlabeled Synonyms 1,3,5(10)-estratrien-2,3-diol-17-one 2-Methyl Ether; 3-Hydroxy-2-methoxyestra-1,3,5(10)-trien-17-one
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