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3,4,5,6-TETRADEHYDRODOLICHANTOSIDE

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3,4,5,6-TETRADEHYDRODOLICHANTOSIDE
SpectraBase Compound ID CIL1JC8HkEO
InChI InChI=1S/C28H32N2O9/c1-4-14-17(11-20-22-16(9-10-30(20)2)15-7-5-6-8-19(15)29-22)18(26(35)36-3)13-37-27(14)39-28-25(34)24(33)23(32)21(12-31)38-28/h4-10,13-14,17,21,23-25,27-28,31-34H,1,11-12H2,2-3H3/p+1/t14-,17+,21-,23-,24+,25-,27+,28+/m0/s1
InChIKey GXKSDIFDAFRNGH-MJDPFUCESA-O
Mol Weight 541.6 g/mol
Molecular Formula C28H33N2O9
Exact Mass 541.218606 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1wXXPzTR7f9
Name 3,4,5,6-TETRADEHYDRODOLICHANTOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H33N2O9
InChI InChI=1S/C28H32N2O9/c1-4-14-17(11-20-22-16(9-10-30(20)2)15-7-5-6-8-19(15)29-22)18(26(35)36-3)13-37-27(14)39-28-25(34)24(33)23(32)21(12-31)38-28/h4-10,13-14,17,21,23-25,27-28,31-34H,1,11-12H2,2-3H3/p+1/t14-,17+,21-,23-,24+,25-,27+,28+/m0/s1
InChIKey GXKSDIFDAFRNGH-MJDPFUCESA-O
Literature Reference Author V.BRANDT,M.TITS,A.GEERLINGS,M.FRDERICH,J.PENELLE,C.DELAUDE,R .VERPOORTE,L.ANGENOT
Literature Reference Citation PHYTOCHEM.,51,1171(1999)
Literature Reference DOI 10.1016/S0031-9422(99)00129-6
Molecular Weight 541.578 g/mol
Solvent CD3OD