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KERMADECIN-G

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KERMADECIN-G
SpectraBase Compound ID DVbUzoHl7vq
InChI InChI=1S/C31H44O6/c1-31(2)30(36)29(35)27-24(37-31)19-21-16-14-12-10-8-6-4-3-5-7-9-11-13-15-20-17-22(32)26(23(33)18-20)25(21)28(27)34/h17-19,29-30,32-36H,3-16H2,1-2H3/t29-,30+/m0/s1
InChIKey JGQYDQYOSZZXBA-XZWHSSHBSA-N
Mol Weight 512.7 g/mol
Molecular Formula C31H44O6
Exact Mass 512.313789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5xqWj3cePQa
Name KERMADECIN-G
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H44O6
InChI InChI=1S/C31H44O6/c1-31(2)30(36)29(35)27-24(37-31)19-21-16-14-12-10-8-6-4-3-5-7-9-11-13-15-20-17-22(32)26(23(33)18-20)25(21)28(27)34/h17-19,29-30,32-36H,3-16H2,1-2H3/t29-,30+/m0/s1
InChIKey JGQYDQYOSZZXBA-XZWHSSHBSA-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 512.687 g/mol
Sample ID 44787
Solvent CD3OD