3-O-Methyl Fulvestrant
Product Code
TRC-M305430-25MG
CAS Number
Product Format
Neat
Molecular Formula
C33 H49 F5 O3 S
Molecular Weight
620.797
Product Categories
Price and availability
Product Information
Product Data
Analyte Name
3-O-Methyl Fulvestrant
CAS Number
1221256-46-7
Molecular Formula
C33 H49 F5 O3 S
Molecular Weight
620.797
Accurate Mass
620.332
SMILES
COc1ccc2[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@@H]3[C@H](CCCCCCCCCS(=O)CCCC(F)(F)C(F)(F)F)Cc2c1
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
IUPAC
(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
Storage & Transport Information
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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