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

*Links on SpectraBase are not permalinks.
CHALCANE-3-O-BETA-D-4-O-METHYLGLUCOPYRANOSIDE
SpectraBase Compound ID ANSPCuVaLqG
InChI InChI=1S/C22H28O8/c1-28-21-17(12-23)30-22(20(27)19(21)26)29-16(11-13-7-3-2-4-8-13)18(25)14-9-5-6-10-15(14)24/h2-10,16-27H,11-12H2,1H3/t16?,17-,18?,19-,20-,21-,22-/m0/s1
InChIKey PZZCNULVKCSFTQ-VDGHCRGHSA-N
Mol Weight 420.46 g/mol
Molecular Formula C22H28O8
Exact Mass 420.178418 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 4fCk9YYBsPv
Name CHALCANE-3-O-BETA-D-4-O-METHYLGLUCOPYRANOSIDE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O8
InChI InChI=1S/C22H28O8/c1-28-21-17(12-23)30-22(20(27)19(21)26)29-16(11-13-7-3-2-4-8-13)18(25)14-9-5-6-10-15(14)24/h2-10,16-27H,11-12H2,1H3/t16?,17-,18?,19-,20-,21-,22-/m0/s1
InChIKey PZZCNULVKCSFTQ-VDGHCRGHSA-N
Literature Reference Author W.HERATH,J.R.MIKELL,A.L.HALE,D.FERREIRA,I.A.KHAN
Literature Reference Citation CHEM.PHARM.BULL.,54,320(2006)
Literature Reference DOI 10.1248/cpb.54.320
Molecular Weight 420.460 g/mol
Sample ID 37136
Solvent CDCl3:CD3OD