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

*Links on SpectraBase are not permalinks.
6''-O-MALONYLSAIKOSAPONIN-D
SpectraBase Compound ID Eh5U0QEcIn6
InChI InChI=1S/C45H70O16/c1-22-31(51)36(61-37-34(54)33(53)32(52)23(59-37)19-56-30(50)16-29(48)49)35(55)38(58-22)60-28-10-11-40(4)24(41(28,5)20-46)8-12-42(6)25(40)9-13-45-26-17-39(2,3)14-15-44(26,21-57-45)27(47)18-43(42,45)7/h9,13,22-28,31-38,46-47,51-55H,8,10-12,14-21H2,1-7H3,(H,48,49)/t22-,23-,24?,25?,26?,27-,28+,31+,32-,33+,34-,35-,36+,37+,38+,40+,41+,42-,43+,44-,45+/m1/s1
InChIKey ZFGHOZUWNKDBHB-PGRXIIMASA-N
Mol Weight 867.0 g/mol
Molecular Formula C45H70O16
Exact Mass 866.466386 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 B3Tw5ZrI2Zh
Name 6''-O-MALONYLSAIKOSAPONIN-D
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H70O16
InChI InChI=1S/C45H70O16/c1-22-31(51)36(61-37-34(54)33(53)32(52)23(59-37)19-56-30(50)16-29(48)49)35(55)38(58-22)60-28-10-11-40(4)24(41(28,5)20-46)8-12-42(6)25(40)9-13-45-26-17-39(2,3)14-15-44(26,21-57-45)27(47)18-43(42,45)7/h9,13,22-28,31-38,46-47,51-55H,8,10-12,14-21H2,1-7H3,(H,48,49)/t22-,23-,24?,25?,26?,27-,28+,31+,32-,33+,34-,35-,36+,37+,38+,40+,41+,42-,43+,44-,45+/m1/s1
InChIKey ZFGHOZUWNKDBHB-PGRXIIMASA-N
Literature Reference Author N.EBATA,K.NAKAJIMA,K.HAYASHI,M.OKADA,M.MARUNO
Literature Reference Citation PHYTOCHEM.,41,895(1996)
Literature Reference DOI 10.1016/0031-9422(95)00720-2
Molecular Weight 867.041 g/mol
Solvent CD3OD
Source File Reference UWLU4118