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INOCALOPHYLLIN-A
SpectraBase Compound ID IGlrU3tXHmA
InChI InChI=1S/C35H44O6/c1-20(2)14-15-26(22(5)6)19-35(17-16-21(3)4)33(40)29(27(18-28(36)37)25-12-10-9-11-13-25)32(39)30-31(38)23(7)24(8)41-34(30)35/h9-14,16,23-24,26-27,39H,5,15,17-19H2,1-4,6-8H3,(H,36,37)/t23-,24-,26?,27?,35?/m1/s1
InChIKey WMAJMUHAAGXJIK-YMGGUQHFSA-N
Mol Weight 560.7 g/mol
Molecular Formula C35H44O6
Exact Mass 560.313789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K9VOFXGGGHq
Name INOCALOPHYLLIN-A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H44O6
InChI InChI=1S/C35H44O6/c1-20(2)14-15-26(22(5)6)19-35(17-16-21(3)4)33(40)29(27(18-28(36)37)25-12-10-9-11-13-25)32(39)30-31(38)23(7)24(8)41-34(30)35/h9-14,16,23-24,26-27,39H,5,15,17-19H2,1-4,6-8H3,(H,36,37)/t23-,24-,26?,27?,35?/m1/s1
InChIKey WMAJMUHAAGXJIK-YMGGUQHFSA-N
Literature Reference Author Y.C.SHEN,M.C.HUNG,L.T.WANG,C.Y.CHEN
Literature Reference Citation CHEM.PHARM.BULL.,51,802(2003)
Literature Reference DOI 10.1248/cpb.51.802
Molecular Weight 560.731 g/mol
Solvent CDCl3
Source File Reference UWLU20056