John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1HU6dWEjnVi SpectraBase Spectrum ID=8ozBB6VLfG5

(accessed ).
ELEUTHEROSIDE-K
SpectraBase Compound ID 1HU6dWEjnVi
InChI InChI=1S/C41H66O11/c1-21-28(43)30(45)31(46)33(50-21)52-32-29(44)24(42)20-49-34(32)51-27-12-13-38(6)25(37(27,4)5)11-14-40(8)26(38)10-9-22-23-19-36(2,3)15-17-41(23,35(47)48)18-16-39(22,40)7/h9,21,23-34,42-46H,10-20H2,1-8H3,(H,47,48)/t21-,23-,24-,25-,26+,27-,28-,29-,30+,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1
InChIKey IBAJNOZMACNWJD-HVUPOBLPSA-N
Mol Weight 735.0 g/mol
Molecular Formula C41H66O11
Exact Mass 734.460513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ozBB6VLfG5
Name SAPONIN_CP_2
Compound Number 4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H66O11
InChI InChI=1S/C41H66O11/c1-21-28(43)30(45)31(46)33(50-21)52-32-29(44)24(42)20-49-34(32)51-27-12-13-38(6)25(37(27,4)5)11-14-40(8)26(38)10-9-22-23-19-36(2,3)15-17-41(23,35(47)48)18-16-39(22,40)7/h9,21,23-34,42-46H,10-20H2,1-8H3,(H,47,48)/t21-,23-,24-,25-,26+,27-,28-,29-,30+,31+,32+,33-,34-,38-,39+,40+,41-/m0/s1
InChIKey IBAJNOZMACNWJD-HVUPOBLPSA-N
Literature Reference Author X.C.LI,C.R.YANG,Y.Q.LIU,R.KASAI,K.OHTANI,K.YAMASAKI,K.MIYAHA RA,K.SHINGU
Literature Reference Citation PHYTOCHEM.,39,1175(1995)
Literature Reference DOI 10.1016/0031-9422(95)00107-I
Molecular Weight 734.968 g/mol
Solvent C5D5N
Source File Reference UWMZ9044
SpectraBase Batch ID 9mZhBTZmttC