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7-EPIClUSIANONE
SpectraBase Compound ID HFd3z436gat
InChI InChI=1S/C33H42O4/c1-21(2)14-15-25-20-32(18-16-22(3)4)28(35)26(27(34)24-12-10-9-11-13-24)29(36)33(30(32)37,31(25,7)8)19-17-23(5)6/h9-14,16-17,25,36H,15,18-20H2,1-8H3/t25-,32-,33+/m0/s1
InChIKey LTDDHUQIMJCFPX-DZMJNENTSA-N
Mol Weight 502.7 g/mol
Molecular Formula C33H42O4
Exact Mass 502.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EwDgZxCo2vR
Name 7-EPIClUSIANONE
Compound Number 10A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H42O4
InChI InChI=1S/C33H42O4/c1-21(2)14-15-25-20-32(18-16-22(3)4)28(35)26(27(34)24-12-10-9-11-13-24)29(36)33(30(32)37,31(25,7)8)19-17-23(5)6/h9-14,16-17,25,36H,15,18-20H2,1-8H3/t25-,32-,33+/m0/s1
InChIKey LTDDHUQIMJCFPX-DZMJNENTSA-N
Literature Reference Author N.TANAKA,Y.TAKAISHI,Y.SHIKISHIMA,Y.NAKANISHI,K.BASTOW,K.H.LE E,G.HONDA,M.ITO,Y.TA
Literature Reference Citation J.NAT.PROD.,67,1870(2004)
Literature Reference DOI 10.1021/np040024+
Molecular Weight 502.694 g/mol
Solvent CDCl3
Source File Reference UWMZ8204