John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=G4aJfLCyGzp SpectraBase Spectrum ID=2bXvNk0UoXh

(accessed ).
MOGROSIDE_II_B;MOGROL_3,25-DI-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID G4aJfLCyGzp
InChI InChI=1S/C42H72O14/c1-20(9-13-27(45)39(4,5)56-37-35(52)33(50)31(48)25(19-44)54-37)21-15-16-40(6)26-12-10-22-23(42(26,8)28(46)17-41(21,40)7)11-14-29(38(22,2)3)55-36-34(51)32(49)30(47)24(18-43)53-36/h10,20-21,23-37,43-52H,9,11-19H2,1-8H3/t20?,21-,23-,24-,25-,26+,27+,28-,29+,30-,31-,32+,33+,34-,35-,36+,37+,40+,41-,42+/m1/s1
InChIKey OMJOQOVMHUWPCF-PBYLDFNBSA-N
Mol Weight 801.0 g/mol
Molecular Formula C42H72O14
Exact Mass 800.492208 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bXvNk0UoXh
Name MOGROSIDE_II_B;MOGROL_3,25-DI-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H72O14
InChI InChI=1S/C42H72O14/c1-20(9-13-27(45)39(4,5)56-37-35(52)33(50)31(48)25(19-44)54-37)21-15-16-40(6)26-12-10-22-23(42(26,8)28(46)17-41(21,40)7)11-14-29(38(22,2)3)55-36-34(51)32(49)30(47)24(18-43)53-36/h10,20-21,23-37,43-52H,9,11-19H2,1-8H3/t20?,21-,23-,24-,25-,26+,27+,28-,29+,30-,31-,32+,33+,34-,35-,36+,37+,40+,41-,42+/m1/s1
InChIKey OMJOQOVMHUWPCF-PBYLDFNBSA-N
Literature Reference Author T.AKIHISA,Y.HAYAKAWA,H.TOKUDA,N.BANNO,N.SHIMIZU,T.SUZUKI,Y.K IMURA
Literature Reference Citation J.NAT.PROD.,70,783(2007)
Literature Reference DOI 10.1021/np068074x
Molecular Weight 801.025 g/mol
Sample ID 30266
Solvent C5D5N
SpectraBase Batch ID FmfC8gX7rPG