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DEMETHYLFLAVASPERONE-GENTIOBIOSIDE

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DEMETHYLFLAVASPERONE-GENTIOBIOSIDE
SpectraBase Compound ID KQCl1xYuE5R
InChI InChI=1S/C27H32O15/c1-9-3-12(29)18-13(30)5-10-4-11(37-2)6-14(17(10)25(18)39-9)40-27-24(36)22(34)20(32)16(42-27)8-38-26-23(35)21(33)19(31)15(7-28)41-26/h3-6,15-16,19-24,26-28,30-36H,7-8H2,1-2H3/t15-,16-,19-,20-,21+,22+,23-,24-,26-,27-/m0/s1
InChIKey CREWSFDYWMXJQL-AJEHSGAESA-N
Mol Weight 596.5 g/mol
Molecular Formula C27H32O15
Exact Mass 596.17412 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Y6QAIXqiH3
Name DEMETHYLFLAVASPERONE-GENTIOBIOSIDE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H32O15
InChI InChI=1S/C27H32O15/c1-9-3-12(29)18-13(30)5-10-4-11(37-2)6-14(17(10)25(18)39-9)40-27-24(36)22(34)20(32)16(42-27)8-38-26-23(35)21(33)19(31)15(7-28)41-26/h3-6,15-16,19-24,26-28,30-36H,7-8H2,1-2H3/t15-,16-,19-,20-,21+,22+,23-,24-,26-,27-/m0/s1
InChIKey CREWSFDYWMXJQL-AJEHSGAESA-N
Literature Reference Author T.HATANO,H.UEBAYASHI,H.ITO,S.SHIOTA,T.TSUCHIYA,T.YOSHIDA
Literature Reference Citation CHEM.PHARM.BULL.,47,1121(1999)
Literature Reference DOI 10.1248/cpb.47.1121
Molecular Weight 596.542 g/mol
Solvent DMSO-D6
Source File Reference UWLU8152