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PHELLINIGNINCISTEROL_A

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PHELLINIGNINCISTEROL_A
SpectraBase Compound ID 5KX5cIJEjbP
InChI InChI=1S/C21H32O5/c1-13(5-6-14(12-22)19(2,3)24)15-7-10-21(25)16-11-18(23)26-17(16)8-9-20(15,21)4/h5-6,11,13-15,17,22,24-25H,7-10,12H2,1-4H3/b6-5+/t13-,14-,15-,17+,20-,21-/m1/s1
InChIKey DPLUBJMWMWJWLE-NURHRALHSA-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 CXiNlQkDSC
Name PHELLINIGNINCISTEROL_A
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O5
InChI InChI=1S/C21H32O5/c1-13(5-6-14(12-22)19(2,3)24)15-7-10-21(25)16-11-18(23)26-17(16)8-9-20(15,21)4/h5-6,11,13-15,17,22,24-25H,7-10,12H2,1-4H3/b6-5+/t13-,14-,15-,17+,20-,21-/m1/s1
InChIKey DPLUBJMWMWJWLE-NURHRALHSA-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 36483
Solvent CD3OD