John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=6vumzge19pu SpectraBase Spectrum ID=2KYDg9IHYXQ

(accessed ).
CHRYSOGESIDE_A;(2-R,3-E)-2-HYDROXY-N-[(2-S,3-R,4-E,8-Z)-1-BETA-D-GLUCOPYRANOSYLOXY-3-HYDROXYHEXADEC-4,8-DIEN-2-YL]-OCTADEC-3-ENAMIDE
SpectraBase Compound ID 6vumzge19pu
InChI InChI=1S/C40H73NO9/c1-3-5-7-9-11-13-15-16-17-19-21-23-25-27-29-34(44)39(48)41-32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)33(43)28-26-24-22-20-18-14-12-10-8-6-4-2/h18,20,26-29,32-38,40,42-47H,3-17,19,21-25,30-31H2,1-2H3,(H,41,48)/b20-18-,28-26+,29-27+/t32-,33+,34+,35-,36-,37+,38-,40-/m0/s1
InChIKey ZSSGCZVAMMVAPO-UPVOVXFTSA-N
Mol Weight 712.0 g/mol
Molecular Formula C40H73NO9
Exact Mass 711.528533 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2KYDg9IHYXQ
Name CHRYSOGESIDE_A;(2-R,3-E)-2-HYDROXY-N-[(2-S,3-R,4-E,8-Z)-1-BETA-D-GLUCOPYRANOSYLOXY-3-HYDROXYHEXADEC-4,8-DIEN-2-YL]-OCTADEC-3-ENAMIDE
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H73NO9
InChI InChI=1S/C40H73NO9/c1-3-5-7-9-11-13-15-16-17-19-21-23-25-27-29-34(44)39(48)41-32(31-49-40-38(47)37(46)36(45)35(30-42)50-40)33(43)28-26-24-22-20-18-14-12-10-8-6-4-2/h18,20,26-29,32-38,40,42-47H,3-17,19,21-25,30-31H2,1-2H3,(H,41,48)/b20-18-,28-26+,29-27+/t32-,33+,34+,35-,36-,37+,38-,40-/m0/s1
InChIKey ZSSGCZVAMMVAPO-UPVOVXFTSA-N
Literature Reference Author X.PENG,Y.WANG,K.SUN,P.LIU,X.YIN,W.ZHU
Literature Reference Citation J.NAT.PROD.,74,1298(2011)
Literature Reference DOI 10.1021/np1008976
Molecular Weight 712.021 g/mol
Sample ID 38365
Solvent DMSO-D6
SpectraBase Batch ID 3kTAn9Ei4vC