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LUPULINOSIDE
SpectraBase Compound ID G8JwVPqrECU
InChI InChI=1S/C25H38O16/c1-9(28)41-25(2)5-4-10-11(21(34)35-3)8-36-22(14(10)25)40-24-20(18(32)16(30)13(7-27)38-24)39-23-19(33)17(31)15(29)12(6-26)37-23/h8,10,12-20,22-24,26-27,29-33H,4-7H2,1-3H3/t10-,12+,13+,14-,15+,16+,17-,18-,19+,20+,22+,23-,24-,25+/m1/s1
InChIKey YSJWHDZQHDVBNW-PFWFIPHXSA-N
Mol Weight 594.6 g/mol
Molecular Formula C25H38O16
Exact Mass 594.215985 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JWQCkUsZrcR
Name LUPULINOSIDE
Compound Number 248
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H38O16
InChI InChI=1S/C25H38O16/c1-9(28)41-25(2)5-4-10-11(21(34)35-3)8-36-22(14(10)25)40-24-20(18(32)16(30)13(7-27)38-24)39-23-19(33)17(31)15(29)12(6-26)37-23/h8,10,12-20,22-24,26-27,29-33H,4-7H2,1-3H3/t10-,12+,13+,14-,15+,16+,17-,18-,19+,20+,22+,23-,24-,25+/m1/s1
InChIKey YSJWHDZQHDVBNW-PFWFIPHXSA-N
Literature Reference Author B.DINDA,S.DEBNATH,Y.HARIGAYA
Literature Reference Citation CHEM.PHARM.BULL.,55,159(2007)
Literature Reference DOI 10.1248/cpb.55.159
Molecular Weight 594.567 g/mol
Sample ID 38044
Solvent D2O:CD3COOD=96:4