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

*Links on SpectraBase are not permalinks.
KALOPANAX-SAPONIN-G;HEDERAGENIN-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID IaeB2p2ei5N
InChI InChI=1S/C48H78O18/c1-22-30(52)32(54)35(57)40(62-22)65-38-25(19-49)63-39(37(59)34(38)56)61-20-26-31(53)33(55)36(58)41(64-26)66-42(60)48-16-14-43(2,3)18-24(48)23-8-9-28-44(4)12-11-29(51)45(5,21-50)27(44)10-13-47(28,7)46(23,6)15-17-48/h8,22,24-41,49-59H,9-21H2,1-7H3/t22-,24+,25-,26-,27-,28-,29+,30-,31-,32+,33+,34-,35+,36-,37-,38-,39-,40+,41+,44+,45+,46-,47-,48+/m1/s1
InChIKey YGSBJLPWANWGED-FKOFBGRSSA-N
Mol Weight 943.1 g/mol
Molecular Formula C48H78O18
Exact Mass 942.518816 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 7L8UeLuRiVJ
Name KALOPANAX-SAPONIN-G;HEDERAGENIN-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H78O18
InChI InChI=1S/C48H78O18/c1-22-30(52)32(54)35(57)40(62-22)65-38-25(19-49)63-39(37(59)34(38)56)61-20-26-31(53)33(55)36(58)41(64-26)66-42(60)48-16-14-43(2,3)18-24(48)23-8-9-28-44(4)12-11-29(51)45(5,21-50)27(44)10-13-47(28,7)46(23,6)15-17-48/h8,22,24-41,49-59H,9-21H2,1-7H3/t22-,24+,25-,26-,27-,28-,29+,30-,31-,32+,33+,34-,35+,36-,37-,38-,39-,40+,41+,44+,45+,46-,47-,48+/m1/s1
InChIKey YGSBJLPWANWGED-FKOFBGRSSA-N
Literature Reference Author M.MIYAKOSHI,K.SHIRASUNA,Y.HIRAI,K.SHINGU,S.ISODA,J.SHOJI,Y.I DA,T.SHIMIZU
Literature Reference Citation J.NAT.PROD.,62,445(1999)
Literature Reference DOI 10.1021/np9804334
Molecular Weight 943.137 g/mol
Solvent PYRIDINE-D5
Source File Reference UWCP7885