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3'-METHOXY-3,5,4'-TRIHYDROXYFLAVONE-7-NEOHESPERIDOSIDE
SpectraBase Compound ID K92sk0cDzhH
InChI InChI=1S/C28H32O16/c1-9-18(32)21(35)24(38)27(40-9)44-26-22(36)19(33)16(8-29)43-28(26)41-11-6-13(31)17-15(7-11)42-25(23(37)20(17)34)10-3-4-12(30)14(5-10)39-2/h3-7,9,16,18-19,21-22,24,26-33,35-38H,8H2,1-2H3/t9-,16-,18+,19-,21-,22+,24-,26-,27+,28-/m0/s1
InChIKey SQRDLGLEZIBQLI-BGYLSUHMSA-N
Mol Weight 624.5 g/mol
Molecular Formula C28H32O16
Exact Mass 624.169035 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FMFEHnREeIb
Name 3'-METHOXY-3,5,4'-TRIHYDROXYFLAVONE-7-NEOHESPERIDOSIDE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H32O16
InChI InChI=1S/C28H32O16/c1-9-18(32)21(35)24(38)27(40-9)44-26-22(36)19(33)16(8-29)43-28(26)41-11-6-13(31)17-15(7-11)42-25(23(37)20(17)34)10-3-4-12(30)14(5-10)39-2/h3-7,9,16,18-19,21-22,24,26-33,35-38H,8H2,1-2H3/t9-,16-,18+,19-,21-,22+,24-,26-,27+,28-/m0/s1
InChIKey SQRDLGLEZIBQLI-BGYLSUHMSA-N
Literature Reference Author M.S.ABDEL-KADER,S.I.ALQASOUMI,A.M.A.TAWEEL
Literature Reference Citation CHEM.PHARM.BULL.,57,620(2009)
Literature Reference DOI 10.1248/cpb.57.620
Molecular Weight 624.552 g/mol
Sample ID 2501
Solvent DMSO-D6