John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=F3okrNjktE1

(accessed ).
3-METHOXY-17-ALPHA-[3'-(4''-METHYL)-PHENYL-ISOXAZOL-5'-YL]-ESTRA-1,3,5(10),16-TETRAENE
SpectraBase Compound ID F3okrNjktE1
InChI InChI=1S/C29H31NO2/c1-18-4-6-19(7-5-18)27-17-28(32-30-27)26-13-12-25-24-10-8-20-16-21(31-3)9-11-22(20)23(24)14-15-29(25,26)2/h4-7,9,11,13,16-17,23-25H,8,10,12,14-15H2,1-3H3/t23-,24-,25+,29+/m1/s1
InChIKey CKUDNWPAICLFDG-ANARSLNQSA-N
Mol Weight 425.57 g/mol
Molecular Formula C29H31NO2
Exact Mass 425.235479 g/mol
Enantiomer InChIKey CKUDNWPAICLFDG-RGYUWNBKSA-N
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