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PMO505511
SpectraBase Compound ID KIZtfVJb6Hs
InChI InChI=1S/C31H46O9/c1-9-19(4)29(40-31-28(36)27(35)26(34)24(16-32)39-31)20(5)15-18(3)12-10-11-17(2)13-14-23-21(6)25(33)22(7)30(37-8)38-23/h9-10,12-15,17,20,24,26-29,31-32,34-36H,11,16H2,1-8H3/b12-10+,14-13+,18-15+,19-9+/t17?,20?,24-,26-,27+,28-,29?,31+/m0/s1
InChIKey HUWRGLWOOQKCCY-NLVXAOBCSA-N
Mol Weight 562.7 g/mol
Molecular Formula C31H46O9
Exact Mass 562.314183 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7XmMp9VQdgg
Name PMO505511
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H46O9
InChI InChI=1S/C31H46O9/c1-9-19(4)29(40-31-28(36)27(35)26(34)24(16-32)39-31)20(5)15-18(3)12-10-11-17(2)13-14-23-21(6)25(33)22(7)30(37-8)38-23/h9-10,12-15,17,20,24,26-29,31-32,34-36H,11,16H2,1-8H3/b12-10+,14-13+,18-15+,19-9+/t17?,20?,24-,26-,27+,28-,29?,31+/m0/s1
InChIKey HUWRGLWOOQKCCY-NLVXAOBCSA-N
Literature Reference Author C.SCHLEISSNER,M.PEREZ,A.LOSADA,P.RODRIGUEZ,C.CRESPO,P.ZUNIGA ,R.FERNANDEZ,F.REYES
Literature Reference Citation J.NAT.PROD.,74,1590(2011)
Literature Reference DOI 10.1021/np200196j
Molecular Weight 562.701 g/mol
Sample ID 39029
Solvent CD3OD