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Astragalin
SpectraBase Compound ID E30lRlqhl9S
InChI InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1
InChIKey JPUKWEQWGBDDQB-QSOFNFLRSA-N
Mol Weight 448.38 g/mol
Molecular Formula C21H20O11
Exact Mass 448.100561 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QH9J0n5SL0
Name Astragalin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O11
InChI InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1
InChIKey JPUKWEQWGBDDQB-QSOFNFLRSA-N
Molecular Weight 448.380 g/mol
SMILES Oc1c2c(OC(=C(O[C@]3([C@@]([C@]([C@@]([C@@](CO)(O3)[H])(O)[H])(O)[H])(O)[H])[H])C2=O)c2ccc(cc2)O)cc(c1)O
SPLASH splash10-000i-0090000000-c945014bfd74b2f43eef
Source of Spectrum QA-38-395-B
Synonyms 5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
Wiley ID 1795027