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CHRYSOERIOL_7-O-BETA-(6-O-MALONYL)-GLUCOPYRANOSIDE
SpectraBase Compound ID 8z03WXi1egE
InChI InChI=1S/C25H24O14/c1-35-16-4-10(2-3-12(16)26)15-7-14(28)21-13(27)5-11(6-17(21)38-15)37-25-24(34)23(33)22(32)18(39-25)9-36-20(31)8-19(29)30/h2-7,18,22-27,32-34H,8-9H2,1H3,(H,29,30)/t18-,22-,23+,24-,25-/m0/s1
InChIKey PLQBKZOSLQNLOX-XJTSNBOBSA-N
Mol Weight 548.45 g/mol
Molecular Formula C25H24O14
Exact Mass 548.116605 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9HT879NCAVd
Name CHRYSOERIOL_7-O-BETA-(6-O-MALONYL)-GLUCOPYRANOSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H24O14
InChI InChI=1S/C25H24O14/c1-35-16-4-10(2-3-12(16)26)15-7-14(28)21-13(27)5-11(6-17(21)38-15)37-25-24(34)23(33)22(32)18(39-25)9-36-20(31)8-19(29)30/h2-7,18,22-27,32-34H,8-9H2,1H3,(H,29,30)/t18-,22-,23+,24-,25-/m0/s1
InChIKey PLQBKZOSLQNLOX-XJTSNBOBSA-N
Literature Reference Author J.CONRAD,B.FOERSTER-FROMME,M.A.CONSTANTIN,V.ONDRUS,S.MIKA,F. MERT-BALCI,I.KLAIBER
Literature Reference Citation J.NAT.PROD.,72,835(2009)
Literature Reference DOI 10.1021/np800769g
Molecular Weight 548.457 g/mol
Sample ID 32528
Solvent CD3OD