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KERMADECIN-C

View entire compound with spectra: 1 NMR

KERMADECIN-C
SpectraBase Compound ID 8IUmlgAJmUj
InChI InChI=1S/C31H40O5/c1-31(2)18-17-23-28(34)26-22(29(35)30(23)36-31)16-14-12-10-8-6-4-3-5-7-9-11-13-15-21-19-24(32)27(26)25(33)20-21/h17-20,32-33H,3-16H2,1-2H3
InChIKey LNALKEIQYKOVHK-UHFFFAOYSA-N
Mol Weight 492.7 g/mol
Molecular Formula C31H40O5
Exact Mass 492.287574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C7hOi767TDs
Name KERMADECIN-C
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H40O5
InChI InChI=1S/C31H40O5/c1-31(2)18-17-23-28(34)26-22(29(35)30(23)36-31)16-14-12-10-8-6-4-3-5-7-9-11-13-15-21-19-24(32)27(26)25(33)20-21/h17-20,32-33H,3-16H2,1-2H3
InChIKey LNALKEIQYKOVHK-UHFFFAOYSA-N
Literature Reference Author C.JOLLY,O.THOISON,M.T.MARTIN,V.DUMONTET,A.GILBERT,B.PFEIFFER ,S.LEONCE,T.SEVENET,
Literature Reference Citation PHYTOCHEM.,69,533(2008)
Literature Reference DOI 10.1016/j.phytochem.2007.07.015
Molecular Weight 492.656 g/mol
Sample ID 44783
Solvent CDCl3