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LIGNIVOLONE_C_ACETATE
SpectraBase Compound ID 5qsdA1SCrRW
InChI InChI=1S/C27H40O7/c1-6-7-8-9-10-11-12-13-24(30)31-18-19(2)14-15-22-26(5)27(33-20(3)28)21(29)16-25(4,34-26)17-23(27)32-22/h14-15,23H,6-13,16-18H2,1-5H3/b19-14-,22-15-/t23-,25-,26-,27-/m1/s1
InChIKey PATQLZBILSJEGD-NAFKPBNWSA-N
Mol Weight 476.6 g/mol
Molecular Formula C27H40O7
Exact Mass 476.277404 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HnRSYYbXlSV
Name LIGNIVOLONE_C_ACETATE
Compound Number 3A
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H40O7
InChI InChI=1S/C27H40O7/c1-6-7-8-9-10-11-12-13-24(30)31-18-19(2)14-15-22-26(5)27(33-20(3)28)21(29)16-25(4,34-26)17-23(27)32-22/h14-15,23H,6-13,16-18H2,1-5H3/b19-14-,22-15-/t23-,25-,26-,27-/m1/s1
InChIKey PATQLZBILSJEGD-NAFKPBNWSA-N
Literature Reference Author M.SHIBANO,A.OKUNO,M.TANIGUCHI,K.BABA,N.H.WANG
Literature Reference Citation J.NAT.PROD.,68,1445(2005)
Literature Reference DOI 10.1021/np050008s
Molecular Weight 476.610 g/mol
Solvent CDCl3
Source File Reference UWMZ13182