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4H-1-Benzopyran-4-one, 8-[(2,6-dihydroxy-4-methoxy-3-methylphenyl)phenylmethyl]-5,7-dihydrox y-6-methyl-2-phenyl-
SpectraBase Compound ID 2JDq01PzO9I
InChI InChI=1S/C31H26O7/c1-16-22(37-3)14-20(32)25(28(16)34)24(19-12-8-5-9-13-19)27-30(36)17(2)29(35)26-21(33)15-23(38-31(26)27)18-10-6-4-7-11-18/h4-15,24,32,34-36H,1-3H3
InChIKey SCXJMMJKLWFSGE-UHFFFAOYSA-N
Mol Weight 510.54 g/mol
Molecular Formula C31H26O7
Exact Mass 510.167853 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J6vdlNNFMS8
Name 4H-1-Benzopyran-4-one, 8-[(2,6-dihydroxy-4-methoxy-3-methylphenyl)phenylmethyl]-5,7-dihydrox y-6-methyl-2-phenyl-
Alternate Name(s) 8-[(2,6-dihydroxy-4-methoxy-3-methylphenyl)(phenyl)methyl]-5,7-dihydroxy-6-methyl-2-phenyl-4H-chromen-4-one Dehydromelanervin
CAS Registry Number 60715-61-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H26O7
InChI InChI=1S/C31H26O7/c1-16-22(37-3)14-20(32)25(28(16)34)24(19-12-8-5-9-13-19)27-30(36)17(2)29(35)26-21(33)15-23(38-31(26)27)18-10-6-4-7-11-18/h4-15,24,32,34-36H,1-3H3
InChIKey SCXJMMJKLWFSGE-UHFFFAOYSA-N
Molecular Weight 510.542 g/mol
SMILES Oc1cc(c(c(c1C(c1c2c(c(c(c1O)C)O)C(C=C(O2)c1ccccc1)=O)c1ccccc1)O)C)OC
SPLASH splash10-014i-0591200000-6310b7846b205922b539
Source of Spectrum F-37-2604-0
Wiley ID 1400569