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Fulvestrant 9-Sulfone



Chemical Properties of 'Fulvestrant 9-Sulfone'

CAT No. :

CS-T-55128
CAS Registry No. : 98008-06-1
Category : Metabolites
Molecular Weight: 622.77
Molecular Formula : C₃₂H₄₇F₅O₄S
Controlled Substance : NO
Documents:  View Sample COA   View Sample MSDS



OTHER INFORMATION of 'Fulvestrant 9-Sulfone'
Purity : Not less than 90%
Therapeutic : Anti-Cancer / Oncology
Applicationnotes :A metabolite of Fulvestrant .
Synonym :Fulvestrant EP Impurity B
References :"Rao, P,, et al,: J, Steroid Biochem,, 25, 417 (1986), Wakeling, A,, et al,: J, Steroid Biochem, Mol, Biol,, 43, 173 (1992), DeFriend, D,, et al,: Cancer Res,, 54, 408"
Smileys :C[C@@]12[C@](CC[C@@H]2O)([H])[C@]3([H])[C@@H](CC(C=C(O)C=C4)=C4[C@@]3([H])CC1)CCCCCCCCC[S](CCCC(F)(F)C(F)(F)F)(=O)=O
Appearance :White to off white solid
EC Number :670-947-8
UNII :55928538EN
Other Synonyms :Fulvestrant sulfone
Removed Synonyms :NQYWBGDKCPOMGL-LSVBPWPTSA-N
CompoundIs Canonicalized :Yes
GHS Classification :
Exact Mass :622.31152196
IUPAC Name :(7R,8R,9S,13S,14S,17S)-13-methyl-7-[9-(4,4,5,5,5-pentafluoropentylsulfonyl)nonyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
InChI :InChI=1S/C32H47F5O4S/c1-30-17-15-26-25-12-11-24(38)21-23(25)20-22(29(26)27(30)13-14-28(30)39)10-7-5-3-2-4-6-8-18-42(40,41)19-9-16-31(33,34)32(35,36)37/h11-12,21-22,26-29,38-39H,2-10,13-20H2,1H3/t22-,26-,27+,28+,29-,30+/m1/s1
InchIKey :NQYWBGDKCPOMGL-LSVBPWPTSA-N
Canonical SMILES :CC12CCC3C(C1CCC2O)C(CC4=C3C=CC(=C4)O)CCCCCCCCCS(=O)(=O)CCCC(C(F)(F)F)(F)F
Isomeric SMILES :C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)[C@@H](CC4=C3C=CC(=C4)O)CCCCCCCCCS(=O)(=O)CCCC(C(F)(F)F)(F)F
Hazard Class :Repr. 1B (100%)
Product Description :Fulvestrant 9-sulfone is a 3-hydroxy steroid.
Custom Duty : Applicable
Port of Loading : Canada
Expected Dispatch : 2-3 Weeks
Taxes : Not Applicable
Refund Policy : 30-days money back


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