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(3R,5S)-3,5-DIHYDROXY-1,7-(4-HYDROXY-3-METHOXYPHENYL)-HEPTANE
SpectraBase Compound ID 3Igh5PTvcIi
InChI InChI=1S/C21H28O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h5-6,9-12,16-17,22-25H,3-4,7-8,13H2,1-2H3/t16-,17+
InChIKey OELMAFBLFOKZJD-CALCHBBNSA-N
Mol Weight 376.45 g/mol
Molecular Formula C21H28O6
Exact Mass 376.188589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ewhDUJmtV4
Name (3R,5S)-3,5-DIHYDROXY-1,7-(4-HYDROXY-3-METHOXYPHENYL)-HEPTANE
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O6
InChI InChI=1S/C21H28O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h5-6,9-12,16-17,22-25H,3-4,7-8,13H2,1-2H3/t16-,17+
InChIKey OELMAFBLFOKZJD-CALCHBBNSA-N
Literature Reference Author H.KIKUZAKI,M.KOBAYASHI,N.NAKATANI
Literature Reference Citation PHYTOCHEM.,30,3647(1991)
Literature Reference DOI 10.1016/0031-9422(91)80085-F
Molecular Weight 376.450 g/mol
Solvent ACETONE-D6
Source File Reference UWMS26592