John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=40uppNIrwXR SpectraBase Spectrum ID=1IYFEc1kSqm

(accessed ).
SAKERINOL-B;(E)-3-(METHYLSULFONYL)-PROPENOIC-ACID-(2E,6Z)-3-HYDROXY-4-(8-HYDROXY-3,7-DIMETHYL-2,6-OCTADIENYLOXY)-PHENETHYL-AMIDE
SpectraBase Compound ID 40uppNIrwXR
InChI InChI=1S/C22H31NO6S/c1-17(5-4-6-18(2)16-24)10-13-29-21-8-7-19(15-20(21)25)9-12-23-22(26)11-14-30(3,27)28/h6-8,10-11,14-15,24-25H,4-5,9,12-13,16H2,1-3H3,(H,23,26)/b14-11+,17-10+,18-6-
InChIKey HQPXIDJWLNJWEK-VXCAGMOMSA-N
Mol Weight 437.55 g/mol
Molecular Formula C22H31NO6S
Exact Mass 437.18721 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1IYFEc1kSqm
Name SAKERINOL-B;(E)-3-(METHYLSULFONYL)-PROPENOIC-ACID-(2E,6Z)-3-HYDROXY-4-(8-HYDROXY-3,7-DIMETHYL-2,6-OCTADIENYLOXY)-PHENETHYL-AMIDE
Compound Number 9
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H31NO6S
InChI InChI=1S/C22H31NO6S/c1-17(5-4-6-18(2)16-24)10-13-29-21-8-7-19(15-20(21)25)9-12-23-22(26)11-14-30(3,27)28/h6-8,10-11,14-15,24-25H,4-5,9,12-13,16H2,1-3H3,(H,23,26)/b14-11+,17-10+,18-6-
InChIKey HQPXIDJWLNJWEK-VXCAGMOMSA-N
Literature Reference Author O.HOFER,H.GREGER,B.LUKASEDER,S.VAJRODAYA,M.BACHER
Literature Reference Citation PHYTOCHEM.,54,207(2000)
Literature Reference DOI 10.1016/S0031-9422(00)00011-X
Molecular Weight 437.551 g/mol
Solvent Unknown
Source File Reference UWLU1251
SpectraBase Batch ID 5PXW3Z1Ky3G