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[3,4,5-trihydroxy-6-(6-methoxy-2-oxo-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate

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[3,4,5-trihydroxy-6-(6-methoxy-2-oxo-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate
SpectraBase Compound ID 2lYY1p6xDof
InChI InChI=1S/C26H26O12/c1-33-17-9-13(3-6-15(17)27)4-7-21(28)35-12-20-23(30)24(31)25(32)26(38-20)37-19-11-16-14(10-18(19)34-2)5-8-22(29)36-16/h3-11,20,23-27,30-32H,12H2,1-2H3/b7-4+
InChIKey KHGMBLGKNSKBRV-QPJJXVBHSA-N
Mol Weight 530.48 g/mol
Molecular Formula C26H26O12
Exact Mass 530.142426 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DpemSaqyEMk
Name [3,4,5-Trihydroxy-6-(6-methoxy-2-oxo-chromen-7-yl)oxy-tetrahydropyran-2-yl]methyl (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 530.142426265 u
Formula C26H26O12
InChI InChI=1S/C26H26O12/c1-33-17-9-13(3-6-15(17)27)4-7-21(28)35-12-20-23(30)24(31)25(32)26(38-20)37-19-11-16-14(10-18(19)34-2)5-8-22(29)36-16/h3-11,20,23-27,30-32H,12H2,1-2H3/b7-4+
InChIKey KHGMBLGKNSKBRV-QPJJXVBHSA-N
Molecular Weight 530.482 g/mol
SMILES C1(C(C(O)C(C(O1)COC(\C=C\C1=CC(OC)=C(C=C1)O)=O)O)O)OC1=CC=2OC(=O)C=CC2C=C1OC