Isotope Science / Alfa Chemistry

2-Methoxy-17β-estradiol-1,4,16,16,17-d5

Catalog Number ACM358731347-1
CAS 358731-34-7
Structure Structure
Synonyms 2-Methoxy-17beta-estradiol-1,4,16,16,17-D5
IUPAC Name (8R,9S,13S,14S,17S)-1,4,16,16,17-pentadeuterio-2-methoxy-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthrene-3,17-diol
Molecular Weight 307.44
Molecular Formula C19H21D5O3
InChI InChI=1S/C19H26O3/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/h9-10,12-13,15,18,20-21H,3-8H2,1-2H3/t12-,13+,15-,18-,19-/m0/s1/i6D2,9D,10D,18D
InChI Key CQOQDQWUFQDJMK-AGCGVRMISA-N
Hazards Non-hazardous for transport.
Isomeric SMILES [2H]C1=C2CC[C@@H]3[C@@H](C2=C(C(=C1O)OC)[2H])CC[C@]4([C@H]3CC([C@]4([2H])O)([2H])[2H])C
Isotopic Enrichment 98 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 362-07-2
Unlabeled Synonyms 1,3,5(10)-Estratrien-2,3,17β-triol 2-Methyl Ether
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