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3-(2,3-Dihydroxy-3,7-dimethyl-oct-6-enyl)-2-(2,4-dihydroxy-phenyl)-5,7-dihydroxy-6-(3-methyl-but-2-enyl)-chromen-4-one

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3-(2,3-Dihydroxy-3,7-dimethyl-oct-6-enyl)-2-(2,4-dihydroxy-phenyl)-5,7-dihydroxy-6-(3-methyl-but-2-enyl)-chromen-4-one
SpectraBase Compound ID AlyQG0D1EfN
InChI InChI=1S/C30H36O8/c1-16(2)7-6-12-30(5,37)25(34)14-21-28(36)26-24(15-23(33)19(27(26)35)10-8-17(3)4)38-29(21)20-11-9-18(31)13-22(20)32/h7-9,11,13,15,25,31-35,37H,6,10,12,14H2,1-5H3
InChIKey SHZUYFOFDHWOGK-UHFFFAOYSA-N
Mol Weight 524.6 g/mol
Molecular Formula C30H36O8
Exact Mass 524.241018 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DQpKSyYoqkj
Name 3-(2,3-Dihydroxy-3,7-dimethyl-oct-6-enyl)-2-(2,4-dihydroxy-phenyl)-5,7-dihydroxy-6-(3-methyl-but-2-enyl)-chromen-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 524.241018111 u
Formula C30H36O8
InChI InChI=1S/C30H36O8/c1-16(2)7-6-12-30(5,37)25(34)14-21-28(36)26-24(15-23(33)19(27(26)35)10-8-17(3)4)38-29(21)20-11-9-18(31)13-22(20)32/h7-9,11,13,15,25,31-35,37H,6,10,12,14H2,1-5H3
InChIKey SHZUYFOFDHWOGK-UHFFFAOYSA-N
Molecular Weight 524.610 g/mol
SMILES C1(=C(OC2=CC(O)=C(C(=C2C1=O)O)CC=C(C)C)C=1C(=CC(=CC1)O)O)CC(C(O)(CCC=C(C)C)C)O