John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=FumpTnIiCO2 SpectraBase Spectrum ID=1jK7f0UpLEd

(accessed ).
CINNAFRAGRIN_A
SpectraBase Compound ID FumpTnIiCO2
InChI InChI=1S/C34H48O10/c1-18(36)40-22-15-20-26(38)42-28-34(20,32(8)14-10-12-30(5,6)25(22)32)44-27(43-28)21-16-23(41-19(2)37)24-29(3,4)11-9-13-31(24,7)33(21,39)17-35/h15-17,22-28,38-39H,9-14H2,1-8H3/t22-,23-,24?,25?,26-,27+,28+,31+,32+,33-,34+/m1/s1
InChIKey ASRYDWWUAZEWIH-UOZVWDGMSA-N
Mol Weight 616.7 g/mol
Molecular Formula C34H48O10
Exact Mass 616.324748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1jK7f0UpLEd
Name CINNAFRAGRIN_A
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H48O10
InChI InChI=1S/C34H48O10/c1-18(36)40-22-15-20-26(38)42-28-34(20,32(8)14-10-12-30(5,6)25(22)32)44-27(43-28)21-16-23(41-19(2)37)24-29(3,4)11-9-13-31(24,7)33(21,39)17-35/h15-17,22-28,38-39H,9-14H2,1-8H3/t22-,23-,24?,25?,26-,27+,28+,31+,32+,33-,34+/m1/s1
InChIKey ASRYDWWUAZEWIH-UOZVWDGMSA-N
Literature Reference Author L.HARINANTENAINA,S.TAKAOKA
Literature Reference Citation J.NAT.PROD.,69,1193(2006)
Literature Reference DOI 10.1021/np0601298
Molecular Weight 616.749 g/mol
Solvent CDCl3
Source File Reference UWMZ15582
SpectraBase Batch ID IqfWF3DssXq