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3'-(4'''-(3'''',4''''-dihydroxyphenoxy)-2'''-hydroxyphenoxy)quercetin-3-O-.alpha.-L-fucopyranoside

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3'-(4'''-(3'''',4''''-dihydroxyphenoxy)-2'''-hydroxyphenoxy)quercetin-3-O-.alpha.-L-fucopyranoside
SpectraBase Compound ID 9Uzdo8kdCDf
InChI InChI=1S/C33H28O15/c1-13-27(40)29(42)30(43)33(44-13)48-32-28(41)26-22(39)9-15(34)10-25(26)47-31(32)14-2-5-19(36)24(8-14)46-23-7-4-17(12-21(23)38)45-16-3-6-18(35)20(37)11-16/h2-13,27,29-30,33-40,42-43H,1H3/t13-,27+,29+,30-,33-/m0/s1
InChIKey GGHQCHATARXYQC-GHTAEVAMSA-N
Mol Weight 664.6 g/mol
Molecular Formula C33H28O15
Exact Mass 664.14282 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Q9Q0F5Ln62
Name 3'-(4'''-(3'''',4''''-dihydroxyphenoxy)-2'''-hydroxyphenoxy)quercetin-3-O-.alpha.-L-fucopyranoside
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H28O15
InChI InChI=1S/C33H28O15/c1-13-27(40)29(42)30(43)33(44-13)48-32-28(41)26-22(39)9-15(34)10-25(26)47-31(32)14-2-5-19(36)24(8-14)46-23-7-4-17(12-21(23)38)45-16-3-6-18(35)20(37)11-16/h2-13,27,29-30,33-40,42-43H,1H3/t13-,27+,29+,30-,33-/m0/s1
InChIKey GGHQCHATARXYQC-GHTAEVAMSA-N
Literature Reference DOI 10.1002/cjoc.201190065
Molecular Weight 664.572 g/mol
SMILES Oc1cc(c2C(C(=C(c3cc(Oc4c(O)cc(cc4)Oc4cc(c(cc4)O)O)c(cc3)O)Oc2c1)O[C@@]1(O[C@]([C@]([C@]([C@@]1(O)[H])(O)[H])(O)[H])(C)[H])[H])=O)O
SPLASH splash10-0uy0-2950000000-471cfa91a608096f7e62
Source of Spectrum CJC-29-87-1a
Synonyms 3'-(4'''-(3'''',4''''-Dihydroxyphenoxy)-2'''-hydroxyphenoxy)acanthophorin B 2-(3-(4-(3,4-dihydroxyphenoxy)-2-hydroxyphenoxy)-4-hydroxyphenyl)-5,7-dihydroxy-3-(((2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one 2-[3-[4-(3,4-dihydroxyphenoxy)-2-hydroxyphenoxy]-4-hydroxyphenyl]-5,7-dihydroxy-3-[[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-2-oxanyl]oxy]-1-benzopyran-4-one 2-[3-[4-(3,4-dihydroxyphenoxy)-2-hydroxyphenoxy]-4-hydroxyphenyl]-5,7-dihydroxy-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one 2-[3-[4-(3,4-dihydroxyphenoxy)-2-hydroxy-phenoxy]-4-hydroxy-phenyl]-5,7-dihydroxy-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-chromen-4-one 2-[3-[4-[3,4-bis(oxidanyl)phenoxy]-2-oxidanyl-phenoxy]-4-oxidanyl-phenyl]-3-[(2S,3S,4R,5S,6S)-6-methyl-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-5,7-bis(oxidanyl)chromen-4-one
Wiley ID 1772466