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

*Links on SpectraBase are not permalinks.

12-DEACETOXY-23-ACETOXY-19-O-ACETYLSCALARIN

View entire compound with spectra: 1 NMR

12-DEACETOXY-23-ACETOXY-19-O-ACETYLSCALARIN
SpectraBase Compound ID 7W6S9EIZ0Gi
InChI InChI=1S/C29H42O6/c1-17(30)33-16-29-13-7-12-26(3,4)20(29)10-14-27(5)21-9-8-19-23(28(21,6)15-11-22(27)29)25(34-18(2)31)35-24(19)32/h8,20-23,25H,7,9-16H2,1-6H3/t20?,21?,22?,23-,25-,27+,28+,29-/m1/s1
InChIKey HTBVRXFAQQUUQL-CKHLWQHRSA-N
Mol Weight 486.6 g/mol
Molecular Formula C29H42O6
Exact Mass 486.298139 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 GE6YtFQImUt
Name 12-DEACETOXY-23-ACETOXY-19-O-ACETYLSCALARIN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H42O6
InChI InChI=1S/C29H42O6/c1-17(30)33-16-29-13-7-12-26(3,4)20(29)10-14-27(5)21-9-8-19-23(28(21,6)15-11-22(27)29)25(34-18(2)31)35-24(19)32/h8,20-23,25H,7,9-16H2,1-6H3/t20?,21?,22?,23-,25-,27+,28+,29-/m1/s1
InChIKey HTBVRXFAQQUUQL-CKHLWQHRSA-N
Literature Reference Author J.R.RHO,H.S.LEE,H.J.SHIN,J.W.AHN,J.Y.KIM,C.J.SIM,J.SHIN
Literature Reference Citation J.NAT.PROD.,67,1748(2004)
Literature Reference DOI 10.1021/np040103l
Molecular Weight 486.649 g/mol
Solvent CDCl3
Source File Reference UWMZ6621