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(3A-ALPHA,4AS*,10-ALPHA,15B-BETA,15C-ALPHA)-(+/-)-10-PHENYLTHIO-3A,6,7,10,15B,15C-HEXAHYDRO-2,2-DIMETHYL-5H-[1,3]-DIOXOLO-[4,5-H]-1,3-DIOXO
SpectraBase Compound ID 6MgftWrf0Sy
InChI InChI=1S/C26H27NO5S/c1-25(2)31-20-13-26-9-6-10-27(26)24(28)23(33-15-7-4-3-5-8-15)17-12-19-18(29-14-30-19)11-16(17)21(26)22(20)32-25/h3-5,7-8,11-12,20-23H,6,9-10,13-14H2,1-2H3/t20-,21+,22-,23-,26-/m0/s1
InChIKey GPHHSABMAUWAKT-CTVYPFPQSA-N
Mol Weight 465.56 g/mol
Molecular Formula C26H27NO5S
Exact Mass 465.160994 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IdvhiG6VJih
Name (3A-ALPHA,4AS*,10-ALPHA,15B-BETA,15C-ALPHA)-(+/-)-10-PHENYLTHIO-3A,6,7,10,15B,15C-HEXAHYDRO-2,2-DIMETHYL-5H-[1,3]-DIOXOLO-[4,5-H]-1,3-DIOXO
Compound Number 33-ALPHA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H27NO5S
InChI InChI=1S/C26H27NO5S/c1-25(2)31-20-13-26-9-6-10-27(26)24(28)23(33-15-7-4-3-5-8-15)17-12-19-18(29-14-30-19)11-16(17)21(26)22(20)32-25/h3-5,7-8,11-12,20-23H,6,9-10,13-14H2,1-2H3/t20-,21+,22-,23-,26-/m0/s1
InChIKey GPHHSABMAUWAKT-CTVYPFPQSA-N
Literature Reference Author T.P.BURKHOLDER,P.L.FUCHS
Literature Reference Citation J.AM.CHEM.SOC.,112,9601(1990)
Literature Reference DOI 10.1021/ja00182a019
Molecular Weight 465.564 g/mol
Solvent CDCl3
Source File Reference UWSI1179