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1-ALPHA,7-BETA-DI-(4-METHYLSENECIOYLOXY)-OPLOPA-3(14)Z,8(10)-DIEN-2-ONE
SpectraBase Compound ID 4pOjIQIQEQM
InChI InChI=1S/C27H38O5/c1-9-16(6)12-22(28)31-21-14-20(15(4)5)25-19(11-3)26(30)27(24(25)18(21)8)32-23(29)13-17(7)10-2/h11-13,15,20-21,24-25,27H,8-10,14H2,1-7H3/b16-12+,17-13+,19-11-/t20-,21+,24-,25-,27-/m0/s1
InChIKey JIHQHYGTRUPAHN-JEOJJMGSSA-N
Mol Weight 442.6 g/mol
Molecular Formula C27H38O5
Exact Mass 442.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CVec7D0EmiJ
Name 1-ALPHA,7-BETA-DI-(4-METHYLSENECIOYLOXY)-OPLOPA-3(14)Z,8(10)-DIEN-2-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H38O5
InChI InChI=1S/C27H38O5/c1-9-16(6)12-22(28)31-21-14-20(15(4)5)25-19(11-3)26(30)27(24(25)18(21)8)32-23(29)13-17(7)10-2/h11-13,15,20-21,24-25,27H,8-10,14H2,1-7H3/b16-12+,17-13+,19-11-/t20-,21+,24-,25-,27-/m0/s1
InChIKey JIHQHYGTRUPAHN-JEOJJMGSSA-N
Literature Reference Author Y.YAOITA,H.KAMAZAWA,M.KIKUCHI
Literature Reference Citation CHEM.PHARM.BULL.,47,705(1999)
Literature Reference DOI 10.1248/cpb.47.705
Molecular Weight 442.596 g/mol
Solvent CDCl3
Source File Reference UWLU8018