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[17(2)R]-3-METHOXY-16-ALPHA-METHYL-17(2)-PHENYLSULFONYL-14,17-ETHANOESTRA-1,3,5(10)-TRIENE-15-BETA,16-BETA,17-BETA-TRIOL-17-ACETATE

View entire compound with spectra: 1 NMR

[17(2)R]-3-METHOXY-16-ALPHA-METHYL-17(2)-PHENYLSULFONYL-14,17-ETHANOESTRA-1,3,5(10)-TRIENE-15-BETA,16-BETA,17-BETA-TRIOL-17-ACETATE
SpectraBase Compound ID F2tjUVSV73Q
InChI InChI=1S/C30H36O7S/c1-18(31)37-29-17-25(38(34,35)21-8-6-5-7-9-21)30(26(32)28(29,3)33)24-13-10-19-16-20(36-4)11-12-22(19)23(24)14-15-27(29,30)2/h5-9,11-12,16,23-26,32-33H,10,13-15,17H2,1-4H3/t23?,24?,25-,26+,27+,28-,29-,30+/m0/s1
InChIKey GVEDKMADCJDXRC-MGWIVAIFSA-N
Mol Weight 540.7 g/mol
Molecular Formula C30H36O7S
Exact Mass 540.218175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D98lELRnwEJ
Name [17(2)R]-3-METHOXY-16-ALPHA-METHYL-17(2)-PHENYLSULFONYL-14,17-ETHANOESTRA-1,3,5(10)-TRIENE-15-BETA,16-BETA,17-BETA-TRIOL-17-ACETATE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H36O7S
InChI InChI=1S/C30H36O7S/c1-18(31)37-29-17-25(38(34,35)21-8-6-5-7-9-21)30(26(32)28(29,3)33)24-13-10-19-16-20(36-4)11-12-22(19)23(24)14-15-27(29,30)2/h5-9,11-12,16,23-26,32-33H,10,13-15,17H2,1-4H3/t23?,24?,25-,26+,27+,28-,29-,30+/m0/s1
InChIKey GVEDKMADCJDXRC-MGWIVAIFSA-N
Literature Reference Author J.R.BULL,C.HOADLEY,P.G.MOUNTFORD,L.M.STEER
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1179(1997)
Literature Reference DOI 10.1039/a606242c
Molecular Weight 540.672 g/mol
Solvent CDCl3
Source File Reference UWRU9833