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(3S,5S)-3,5-DIACETOXY-1,7-(3,4-DIACETOXYPHENYL)-HEPTANE

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(3S,5S)-3,5-DIACETOXY-1,7-(3,4-DIACETOXYPHENYL)-HEPTANE
SpectraBase Compound ID 32856syFg6V
InChI InChI=1S/C31H36O12/c1-18(32)38-26(11-7-24-9-13-28(40-20(3)34)30(15-24)42-22(5)36)17-27(39-19(2)33)12-8-25-10-14-29(41-21(4)35)31(16-25)43-23(6)37/h9-10,13-16,26-27H,7-8,11-12,17H2,1-6H3/t26-,27+
InChIKey WBXNSRLTOOKDHI-MKPDMIMOSA-N
Mol Weight 600.6 g/mol
Molecular Formula C31H36O12
Exact Mass 600.220677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6iBv5sMua5D
Name (3S,5S)-3,5-DIACETOXY-1,7-(3,4-DIACETOXYPHENYL)-HEPTANE
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H36O12
InChI InChI=1S/C31H36O12/c1-18(32)38-26(11-7-24-9-13-28(40-20(3)34)30(15-24)42-22(5)36)17-27(39-19(2)33)12-8-25-10-14-29(41-21(4)35)31(16-25)43-23(6)37/h9-10,13-16,26-27H,7-8,11-12,17H2,1-6H3/t26-,27+
InChIKey WBXNSRLTOOKDHI-MKPDMIMOSA-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 600.620 g/mol
Solvent CDCl3
Source File Reference UWMS26597