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3-BETA-O-ACETYL-14-HYDROXY-5-BETA-CARDA-16,20(22)-DIENOLID
SpectraBase Compound ID I4IzENJhv5x
InChI InChI=1S/C25H34O5/c1-15(26)30-18-6-9-23(2)17(13-18)4-5-21-20(23)7-10-24(3)19(8-11-25(21,24)28)16-12-22(27)29-14-16/h8,12,17-18,20-21,28H,4-7,9-11,13-14H2,1-3H3/t17-,18+,20+,21-,23+,24-,25+/m1/s1
InChIKey ZFOWEHOYGUOBFU-GSXJYBCVSA-N
Mol Weight 414.5 g/mol
Molecular Formula C25H34O5
Exact Mass 414.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9y0fR9bTT26
Name 3-BETA-O-ACETYL-14-HYDROXY-5-BETA-CARDA-16,20(22)-DIENOLID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H34O5
InChI InChI=1S/C25H34O5/c1-15(26)30-18-6-9-23(2)17(13-18)4-5-21-20(23)7-10-24(3)19(8-11-25(21,24)28)16-12-22(27)29-14-16/h8,12,17-18,20-21,28H,4-7,9-11,13-14H2,1-3H3/t17-,18+,20+,21-,23+,24-,25+/m1/s1
InChIKey ZFOWEHOYGUOBFU-GSXJYBCVSA-N
Literature Reference Author K.TORI,H.ISHII,Z.W.WOLKOWSKI,C.CHACHATY,M.SANGARE,F.PIRIOU,G .LUKACS
Literature Reference Citation TETRAH.LETT.,14,1077(1973)
Literature Reference DOI 10.1016/S0040-4039(01)95908-8
Molecular Weight 414.542 g/mol
Solvent CDCl3:CD3OD
Source File Reference UNIW8459