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HERICERIN;6-[(2'E)-3',7'-DIMETHYL-2',6'-OCTADIENYL]-7-HYDROXY-5-METHOXY-N-(2''-PHENYLETHYL)-1-ISOINDOLINONE
SpectraBase Compound ID 7Myoax7u9uV
InChI InChI=1S/C27H33NO3/c1-19(2)9-8-10-20(3)13-14-23-24(31-4)17-22-18-28(27(30)25(22)26(23)29)16-15-21-11-6-5-7-12-21/h5-7,9,11-13,17,29H,8,10,14-16,18H2,1-4H3/b20-13+
InChIKey ULSKNVPXNYBAQZ-DEDYPNTBSA-N
Mol Weight 419.6 g/mol
Molecular Formula C27H33NO3
Exact Mass 419.246044 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DSpzURKGk97
Name HERICERIN;6-[(2'E)-3',7'-DIMETHYL-2',6'-OCTADIENYL]-7-HYDROXY-5-METHOXY-N-(2''-PHENYLETHYL)-1-ISOINDOLINONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H33NO3
InChI InChI=1S/C27H33NO3/c1-19(2)9-8-10-20(3)13-14-23-24(31-4)17-22-18-28(27(30)25(22)26(23)29)16-15-21-11-6-5-7-12-21/h5-7,9,11-13,17,29H,8,10,14-16,18H2,1-4H3/b20-13+
InChIKey ULSKNVPXNYBAQZ-DEDYPNTBSA-N
Literature Reference Author Y.KIMURA,M.NISHIBE,H.NAKAJIMA,T.HAMASAKI,A.SHIMADA,A.TSUNEDA ,N.SHIGEMATSU
Literature Reference Citation AGR.BIOL.CHEM.,55,2673(1991)
Literature Reference DOI 10.1271/bbb1961.55.2673
Molecular Weight 419.564 g/mol
Source File Reference UWBT7801