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PHELLINIGNINCISTEROL_B

View entire compound with spectra: 1 NMR

PHELLINIGNINCISTEROL_B
SpectraBase Compound ID 2FewaMjXXu3
InChI InChI=1S/C21H32O5/c1-13(6-10-20(5,24)18(2,3)23)14-7-11-21(25)15-12-17(22)26-16(15)8-9-19(14,21)4/h6,10,12-14,16,23-25H,7-9,11H2,1-5H3/b10-6+/t13-,14-,16+,19-,20+,21-/m1/s1
InChIKey KJLCZLBABYCKPW-FCJJIVSASA-N
Mol Weight 364.5 g/mol
Molecular Formula C21H32O5
Exact Mass 364.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8jsmpVxxffq
Name PHELLINIGNINCISTEROL_B
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-13(6-10-20(5,24)18(2,3)23)14-7-11-21(25)15-12-17(22)26-16(15)8-9-19(14,21)4/h6,10,12-14,16,23-25H,7-9,11H2,1-5H3/b10-6+/t13-,14-,16+,19-,20+,21-/m1/s1
InChIKey KJLCZLBABYCKPW-FCJJIVSASA-N
Literature Reference Author X.WU,S.LIN,C.ZHU,Z.YUE,Y.YU,F.ZHAO,B.LIU,J.DAI,J.SHI
Literature Reference Citation J.NAT.PROD.,73,1294(2010)
Literature Reference DOI 10.1021/np100216k
Molecular Weight 364.482 g/mol
Sample ID 36484
Solvent CD3OD