3-O-Methyl Fulvestrant - CAS 1221256-46-7

Catalog: BB059704
Product Name: 3-O-Methyl Fulvestrant
CAS: 1221256-46-7
Synonyms: (7α,17β)-3-methoxy-7-[9-[(4,4,5,5,5-pentafluoropentyl)sulfinyl]nonyl]estra-1,3,5(10)-trien-17-ol
3-O-Methyl Fulvestrant
IUPAC Name:(7R,8R,9S,13S,14S,17S)-3-methoxy-13-methyl-7-[9-(4,4,5,5,5-pentafluoropentylsulfinyl)nonyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol
Description:3-O-Methyl Fulvestrant, is a derivative of Fulvestrant (F862502), a novel steroidal estrogen antagonist reported to lack any partial agonist activity. Antineoplastic (hormonal).
Molecular Weight:620.8
Molecular Formula:C33H49F5O3S
Canonical SMILES:CC12CCC3C(C1CCC2O)C(CC4=C3C=CC(=C4)OC)CCCCCCCCCS(=O)CCCC(C(F)(F)F)(F)F
InChI:InChI=1S/C33H49F5O3S/c1-31-18-16-27-26-13-12-25(41-2)22-24(26)21-23(30(27)28(31)14-15-29(31)39)11-8-6-4-3-5-7-9-19-42(40)20-10-17-32(34,35)33(36,37)38/h12-13,22-23,27-30,39H,3-11,14-21H2,1-2H3/t23-,27-,28+,29+,30-,31+,42?/m1/s1
InChI Key:QRQZOWKZNIIWRQ-VNXSLSSRSA-N
References:Wakeling, A.E., et al. Cancer Res., 51, 3867 (1991), Howell, A., et al. Br. J. Cancer, 74, 300 (1996), Robertson, J.F., et al. Cancer Res., 61, 6739 (2001),.

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