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4H-1-Benzopyran-4-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-2,5,7-trihydroxy-3-methoxy-, trans-
SpectraBase Compound ID JLGw3QoKiqP
InChI InChI=1S/C18H18O8/c1-23-12-5-4-9(6-13(12)24-2)18(22)17(25-3)16(21)15-11(20)7-10(19)8-14(15)26-18/h4-8,17,19-20,22H,1-3H3
InChIKey DJGSGGDCETXPHI-UHFFFAOYSA-N
Mol Weight 362.33 g/mol
Molecular Formula C18H18O8
Exact Mass 362.100168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E01Su61bTaZ
Name 4H-1-Benzopyran-4-one, 2-(3,4-dimethoxyphenyl)-2,3-dihydro-2,5,7-trihydroxy-3-methoxy-, trans-
CAS Registry Number 51841-82-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O8
InChI InChI=1S/C18H18O8/c1-23-12-5-4-9(6-13(12)24-2)18(22)17(25-3)16(21)15-11(20)7-10(19)8-14(15)26-18/h4-8,17,19-20,22H,1-3H3
InChIKey DJGSGGDCETXPHI-UHFFFAOYSA-N
Molecular Weight 362.334 g/mol
SMILES Oc1cc(cc2c1C(C(C(O2)(c1cc(OC)c(cc1)OC)O)OC)=O)O
SPLASH splash10-0gbc-0906000000-10173f3aa4cd730b6a46
Source of Spectrum AC-1975-2690-3
Synonyms 2,5,7-Trihydroxy-3,3',4'-trimethoxy-flavanone 2-(3,4-dimethoxyphenyl)-2,5,7-trihydroxy-3-methoxy-2,3-dihydro-4H-chromen-4-one
Wiley ID 1349428