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Myricitrin
SpectraBase Compound ID 9SrwH7QPYIO
InChI InChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3
InChIKey DCYOADKBABEMIQ-UHFFFAOYSA-N
Mol Weight 464.38 g/mol
Molecular Formula C21H20O12
Exact Mass 464.095476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FU1DGm4AWmv
Name Myricitrin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O12
InChI InChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3
InChIKey DCYOADKBABEMIQ-UHFFFAOYSA-N
Molecular Weight 464.379 g/mol
SMILES Oc1cc(c2c(OC(=C(OC3C(C(C(C(O3)C)O)O)O)C2=O)c2cc(O)c(c(c2)O)O)c1)O
SPLASH splash10-0gb9-0209000000-728068d320d3ebf830c2
Source of Spectrum O1-60-2561-2
Synonyms 3-[6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-5,7-bis(oxidanyl)-2-[3,4,5-tris(oxidanyl)phenyl]chromen-4-one 5,7-Dihydroxy-3-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one 5,7-Dihydroxy-3-(3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromone 5,7-Dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one 5,7-Dihydroxy-3-[(3,4,5-trihydroxy-6-methyl-2-oxanyl)oxy]-2-(3,4,5-trihydroxyphenyl)-1-benzopyran-4-one
Wiley ID 1592252