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THYSASPATHONE;3-BETA,4-BETA:15,16-DIEPOXY-13(16),14-CLERODADIENE-7-ONE
SpectraBase Compound ID Bf0dWViEplM
InChI InChI=1S/C20H28O3/c1-13-15(21)11-19(3)16(5-6-17-20(19,4)23-17)18(13,2)9-7-14-8-10-22-12-14/h8,10,12-13,16-17H,5-7,9,11H2,1-4H3/t13-,16-,17-,18+,19-,20-/m0/s1
InChIKey GTOUZPGAOUMCHY-YHBMAJSFSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7BYqsOSXSoZ
Name THYSASPATHONE;3-BETA,4-BETA:15,16-DIEPOXY-13(16),14-CLERODADIENE-7-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-13-15(21)11-19(3)16(5-6-17-20(19,4)23-17)18(13,2)9-7-14-8-10-22-12-14/h8,10,12-13,16-17H,5-7,9,11H2,1-4H3/t13-,16-,17-,18+,19-,20-/m0/s1
InChIKey GTOUZPGAOUMCHY-YHBMAJSFSA-N
Literature Reference Author L.HARINANTENAINA,Y.TAKAHARA,T.NISHIZAWA,C.KOHCHI,G.I.SOMA,Y. ASAKAWA
Literature Reference Citation CHEM.PHARM.BULL.,54,1046(2006)
Literature Reference DOI 10.1248/cpb.54.1046
Molecular Weight 316.441 g/mol
Sample ID 37240
Solvent CDCl3