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

*Links on SpectraBase are not permalinks.
SCOPOLETIN-7-O-BETA-D-XYLOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 22lUQQpXvb8
InChI InChI=1S/C21H26O13/c1-29-11-4-8-2-3-14(23)32-10(8)5-12(11)33-21-19(28)17(26)16(25)13(34-21)7-31-20-18(27)15(24)9(22)6-30-20/h2-5,9,13,15-22,24-28H,6-7H2,1H3/t9-,13-,15+,16-,17+,18-,19-,20+,21-/m1/s1
InChIKey AHBJPGDMGKOLJC-OJHUANBKSA-N
Mol Weight 486.43 g/mol
Molecular Formula C21H26O13
Exact Mass 486.137341 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 92KfmcxaOtt
Name SCOPOLETIN-7-O-BETA-D-XYLOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O13
InChI InChI=1S/C21H26O13/c1-29-11-4-8-2-3-14(23)32-10(8)5-12(11)33-21-19(28)17(26)16(25)13(34-21)7-31-20-18(27)15(24)9(22)6-30-20/h2-5,9,13,15-22,24-28H,6-7H2,1H3/t9-,13-,15+,16-,17+,18-,19-,20+,21-/m1/s1
InChIKey AHBJPGDMGKOLJC-OJHUANBKSA-N
Literature Reference Author J.KITAJIMA,A.KAMOSHITA,T.ISHIKAWA,A.TAKANO,T.FUKUDA,S.ISODA, Y.IDA
Literature Reference Citation CHEM.PHARM.BULL.,51,1106(2003)
Literature Reference DOI 10.1248/cpb.51.1106
Molecular Weight 486.430 g/mol
Solvent DMSO-D6
Source File Reference UWLU20311