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(2S)-5,7,3',5'-TETRAHYDROXY-FLAVANONE-7-O-NEOHESPERIDOSIDE

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(2S)-5,7,3',5'-TETRAHYDROXY-FLAVANONE-7-O-NEOHESPERIDOSIDE
SpectraBase Compound ID A6LT8LwnVDs
InChI InChI=1S/C27H32O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-13-5-14(31)19-15(32)7-16(40-17(19)6-13)10-2-11(29)4-12(30)3-10/h2-6,9,16,18,20-31,33-37H,7-8H2,1H3/t9-,16+,18+,20-,21+,22+,23-,24+,25+,26-,27+/m1/s1
InChIKey VIZOIWONWPNYQB-PBXHNEPHSA-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 7StwvlUyI3S
Name (2S)-5,7,3',5'-TETRAHYDROXY-FLAVANONE-7-O-NEOHESPERIDOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H32O15
InChI InChI=1S/C27H32O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-13-5-14(31)19-15(32)7-16(40-17(19)6-13)10-2-11(29)4-12(30)3-10/h2-6,9,16,18,20-31,33-37H,7-8H2,1H3/t9-,16+,18+,20-,21+,22+,23-,24+,25+,26-,27+/m1/s1
InChIKey VIZOIWONWPNYQB-PBXHNEPHSA-N
Literature Reference Author X.L.WANG,N.L.WANG,Y.ZHANG,H.GAO,W.Y.PANG,M.S.WONG,G.ZHANG,L. QIN,X.S.YAO
Literature Reference Citation CHEM.PHARM.BULL.,56,46(2008)
Literature Reference DOI 10.1248/cpb.56.46
Molecular Weight 596.542 g/mol
Sample ID 1204
Solvent CD3OD