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7,7'-Nonane-1,9-diylbis[estra-1,3,5(10)-triene-3,17Beta-diol] (Mixture of Diastereomers)

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For Research Use Only | Not For Clinical Use
CATAPS005027
Synonyms7ξ,7'ξ-Nonane-1,9-diylbis[estra-1,3,5(10)-triene-3,17β-diol],Fulvestrant Imp. D (EP), Fulvestrant sterol dimer
IUPAC Name(8R,9S,13S,14S,17S)-7-[9-[(8R,9S,13S,14S,17S)-3,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-7-yl]nonyl]-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Molecular Weight668.99
Molecular FormulaC45H64O4
Canonical SMILESC[C@]12CC[C@H]3[C@@H](C(CCCCCCCCCC4Cc5cc(O)ccc5[C@H]6CC[C@]7(C)[C@@H](O)CC[C@H]7[C@H]46)Cc8cc(O)ccc38)[C@@H]1CC[C@@H]2O
InChIInChI=1S/C45H64O4/c1-44-22-20-36-34-14-12-32(46)26-30(34)24-28(42(36)38(44)16-18-40(44)48)10-8-6-4-3-5-7-9-11-29-25-31-27-33(47)13-15-35(31)37-21-23-45(2)39(43(29)37)17-19-41(45)49/h12-15,26-29,36-43,46-49H,3-11,16-25H2,1-2H3/t28?,29?,36-,37-,38+,39+,40+,41+,42-,43-,44+,45+/m1/s1
Accurate Mass668.4805
FormatNeat
ShippingRoom Temperature
Size1MG
Storage Conditions2-8°C Fridge/Coldroom
SubcategoryImpurity standards, Chiral molecules
TypeImpurity
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