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

*Links on SpectraBase are not permalinks.
14-DEHYDRO-AGROSTISTACHIN-4-MONOACETATE;TWO_CONFORMERS
SpectraBase Compound ID AQ9uQIuyeyd
InChI InChI=1S/2C22H30O4/c2*1-13-7-8-18-19(22(18,5)6)12-15(3)21(25)20(26-16(4)23)11-14(2)10-17(24)9-13/h2*9,11-12,18-20H,7-8,10H2,1-6H3/b2*13-9-,14-11+,15-12+
InChIKey WVWMDMYXJAFFFK-LLFMGYJASA-N
Mol Weight 716.96 g/mol
Molecular Formula C44H60O8
Exact Mass 716.428819 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 Gd3HmAsRLuE
Name 14-DEHYDRO-AGROSTISTACHIN-4-MONOACETATE;TWO_CONFORMERS
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H60O8
InChI InChI=1S/2C22H30O4/c2*1-13-7-8-18-19(22(18,5)6)12-15(3)21(25)20(26-16(4)23)11-14(2)10-17(24)9-13/h2*9,11-12,18-20H,7-8,10H2,1-6H3/b2*13-9-,14-11+,15-12+
InChIKey WVWMDMYXJAFFFK-LLFMGYJASA-N
Literature Reference Author Y.H.CHOI,J.M.PEZZUTO,A.D.KINGHORN,N.R.FARNSWORTH
Literature Reference Citation J.NAT.PROD.,51,110(1988)
Literature Reference DOI 10.1021/np50055a016
Molecular Weight 716.956 g/mol
Solvent CDCl3
Source File Reference UWED17486