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SEMIMYRTUCOMMULONE;MAJOR-ROTAMER
SpectraBase Compound ID 5bILWRUotAc
InChI InChI=1S/C25H34O7/c1-10(2)13(15-21(30)24(6,7)23(32)25(8,9)22(15)31)14-18(27)12(5)19(28)16(20(14)29)17(26)11(3)4/h10-11,13,27-30H,1-9H3
InChIKey LQOPKPCZNCPZQE-UHFFFAOYSA-N
Mol Weight 446.5 g/mol
Molecular Formula C25H34O7
Exact Mass 446.230453 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9w0pzou2YgE
Name SEMIMYRTUCOMMULONE;MAJOR-ROTAMER
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H34O7
InChI InChI=1S/C25H34O7/c1-10(2)13(15-21(30)24(6,7)23(32)25(8,9)22(15)31)14-18(27)12(5)19(28)16(20(14)29)17(26)11(3)4/h10-11,13,27-30H,1-9H3
InChIKey LQOPKPCZNCPZQE-UHFFFAOYSA-N
Literature Reference Author G.APPENDINO,F.BIANCHI,A.MINASSI,O.STERNER,M.BALLERO,S.GIBBON S
Literature Reference Citation J.NAT.PROD.,65,334(2002)
Literature Reference DOI 10.1021/np010441b
Molecular Weight 446.541 g/mol
Solvent CDCl3
Source File Reference UWSI4047