John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=IGZnIABqiGU SpectraBase Spectrum ID=2a9Ume78FXN

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GARDENOIN_B
SpectraBase Compound ID IGZnIABqiGU
InChI InChI=1S/C31H42O5/c1-18-13-21(35-16-18)14-19(2)22-7-9-29(5)24-15-23-26(20(3)27(33)36-23)31(10-8-25(32)34-6)17-30(24,31)12-11-28(22,29)4/h13,16,19,22-24,26H,3,7-12,14-15,17H2,1-2,4-6H3/t19-,22-,23-,24+,26-,28-,29+,30+,31-/m1/s1
InChIKey XSIGSTVCMUBHQD-PDRQEGEBSA-N
Mol Weight 494.7 g/mol
Molecular Formula C31H42O5
Exact Mass 494.303225 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2a9Ume78FXN
Name GARDENOIN_B
Compound Number 2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H42O5
InChI InChI=1S/C31H42O5/c1-18-13-21(35-16-18)14-19(2)22-7-9-29(5)24-15-23-26(20(3)27(33)36-23)31(10-8-25(32)34-6)17-30(24,31)12-11-28(22,29)4/h13,16,19,22-24,26H,3,7-12,14-15,17H2,1-2,4-6H3/t19-,22-,23-,24+,26-,28-,29+,30+,31-/m1/s1
InChIKey XSIGSTVCMUBHQD-PDRQEGEBSA-N
Literature Reference Author T.NUANYAI,S.CHOKPAIBOON,T.VILAIVAN,K.PUDHOM
Literature Reference Citation J.NAT.PROD.,73,51(2010)
Literature Reference DOI 10.1021/np900658t
Molecular Weight 494.671 g/mol
Sample ID 34346
Solvent CDCl3
SpectraBase Batch ID FiWeoba3dG6