For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
PULICANONE-TRIACETATE;(1E)-6-ALPHA,8-BETA,14-TRIACETOXY-7-BETA-H-GERMACRA-1(10),4(15)-DIEN-15-ONE
SpectraBase Compound ID EICuyxo0Tqn
InChI InChI=1S/C21H30O7/c1-12(2)19-18(27-15(5)23)10-17(11-26-14(4)22)9-7-8-13(3)20(25)21(19)28-16(6)24/h9,12,18-19,21H,3,7-8,10-11H2,1-2,4-6H3/b17-9+/t18-,19+,21+/m1/s1
InChIKey XFOYHMKDRKVKPJ-NRYJDXOVSA-N
Mol Weight 394.46 g/mol
Molecular Formula C21H30O7
Exact Mass 394.199153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6V9nHILxLWV
Name PULICANONE-TRIACETATE;(1E)-6-ALPHA,8-BETA,14-TRIACETOXY-7-BETA-H-GERMACRA-1(10),4(15)-DIEN-15-ONE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O7
InChI InChI=1S/C21H30O7/c1-12(2)19-18(27-15(5)23)10-17(11-26-14(4)22)9-7-8-13(3)20(25)21(19)28-16(6)24/h9,12,18-19,21H,3,7-8,10-11H2,1-2,4-6H3/b17-9+/t18-,19+,21+/m1/s1
InChIKey XFOYHMKDRKVKPJ-NRYJDXOVSA-N
Literature Reference Author J.TRIANA,M.LOPEZ,F.J.PEREZ,J.GONZALEZ-PLATAS,J.QUINTANA,F.ES TEVEZ,F.LEON,J.BERME
Literature Reference Citation J.NAT.PROD.,68,523(2005)
Literature Reference DOI 10.1021/np0496183
Molecular Weight 394.465 g/mol
Solvent CDCl3
Source File Reference UWMZ9753