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6-O-TRANS-CINNAMOYL-E-HARPAGOSIDE
SpectraBase Compound ID LlNYIS8Q64R
InChI InChI=1S/C33H36O12/c1-32(45-25(36)15-13-21-10-6-3-7-11-21)18-23(43-24(35)14-12-20-8-4-2-5-9-20)33(40)16-17-41-31(29(32)33)44-30-28(39)27(38)26(37)22(19-34)42-30/h2-17,22-23,26-31,34,37-40H,18-19H2,1H3/b14-12+,15-13+/t22-,23+,26-,27+,28-,29-,30+,31-,32-,33+/m0/s1
InChIKey RGTYZRPQZIEUER-BJVLBNQISA-N
Mol Weight 624.6 g/mol
Molecular Formula C33H36O12
Exact Mass 624.220677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EHONXs2KaQb
Name 6-O-(E)-CINNAMOYL-(E)-HARPAGOSIDE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H36O12
InChI InChI=1S/C33H36O12/c1-32(45-25(36)15-13-21-10-6-3-7-11-21)18-23(43-24(35)14-12-20-8-4-2-5-9-20)33(40)16-17-41-31(29(32)33)44-30-28(39)27(38)26(37)22(19-34)42-30/h2-17,22-23,26-31,34,37-40H,18-19H2,1H3/b14-12+,15-13+/t22-,23+,26-,27+,28-,29-,30+,31-,32-,33+/m0/s1
InChIKey RGTYZRPQZIEUER-BJVLBNQISA-N
Literature Reference Author B.DINDA,D.R.CHOWDHURY,B.C.MOHANTA
Literature Reference Citation CHEM.PHARM.BULL.,57,765(2009)
Literature Reference DOI 10.1248/cpb.57.765
Molecular Weight 624.642 g/mol
Sample ID 2619
Solvent CD3OD