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ISONAHOCOL-D1;METHYL-2,5-DIHYDROXY-3-[12',13'-DIHYDROXY-3',7',11',15'-TETRAMETHYL-2'(Z),6'(E),10'(E),14'-HEXADECATETRAEN-1'-YL]-PHENYLACETATE
SpectraBase Compound ID 3v9rkf8qcLy
InChI InChI=1S/C29H42O6/c1-19(2)15-26(31)28(33)22(5)12-8-11-20(3)9-7-10-21(4)13-14-23-16-25(30)17-24(29(23)34)18-27(32)35-6/h9,12-13,15-17,26,28,30-31,33-34H,7-8,10-11,14,18H2,1-6H3/b20-9-,21-13+,22-12+
InChIKey UHXRUTRCOYCXAF-UMJZQAPLSA-N
Mol Weight 486.6 g/mol
Molecular Formula C29H42O6
Exact Mass 486.298139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K2AZbOc38oz
Name ISONAHOCOL-D1;METHYL-2,5-DIHYDROXY-3-[12',13'-DIHYDROXY-3',7',11',15'-TETRAMETHYL-2'(Z),6'(E),10'(E),14'-HEXADECATETRAEN-1'-YL]-PHENYLACETATE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H42O6
InChI InChI=1S/C29H42O6/c1-19(2)15-26(31)28(33)22(5)12-8-11-20(3)9-7-10-21(4)13-14-23-16-25(30)17-24(29(23)34)18-27(32)35-6/h9,12-13,15-17,26,28,30-31,33-34H,7-8,10-11,14,18H2,1-6H3/b20-9-,21-13+,22-12+
InChIKey UHXRUTRCOYCXAF-UMJZQAPLSA-N
Literature Reference Author N.TSUCHIYA,A.SATO,H.HARUYAMA,T.WATANABE,Y.IIJIMA
Literature Reference Citation PHYTOCHEM.,48,1003(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00476-7
Molecular Weight 486.649 g/mol
Solvent CDCl3
Source File Reference UWMS1297