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7-O-.beta.-D-Acetylglucoside-methoxyisoflavone
SpectraBase Compound ID 4FooRMGXmY6
InChI InChI=1S/C30H30O13/c1-15(31)37-14-25-27(39-16(2)32)28(40-17(3)33)29(41-18(4)34)30(43-25)42-21-10-11-22-24(12-21)38-13-23(26(22)35)19-6-8-20(36-5)9-7-19/h6-13,25,27-30H,14H2,1-5H3/t25-,27?,28-,29-,30-/m1/s1
InChIKey FTCLAIAXKAGMBI-RYIQDBBLSA-N
Mol Weight 598.56 g/mol
Molecular Formula C30H30O13
Exact Mass 598.168641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HxelHlOShxH
Name 7-O-.beta.-D-Acetylglucoside-methoxyisoflavone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H30O13
InChI InChI=1S/C30H30O13/c1-15(31)37-14-25-27(39-16(2)32)28(40-17(3)33)29(41-18(4)34)30(43-25)42-21-10-11-22-24(12-21)38-13-23(26(22)35)19-6-8-20(36-5)9-7-19/h6-13,25,27-30H,14H2,1-5H3/t25-,27?,28-,29-,30-/m1/s1
InChIKey FTCLAIAXKAGMBI-RYIQDBBLSA-N
Molecular Weight 598.557 g/mol
SMILES [C@@]1([C@@](C(OC(=O)C)[C@](O[C@]1(Oc1cc2OC=C(C(c2cc1)=O)c1ccc(cc1)OC)[H])(COC(=O)C)[H])(OC(=O)C)[H])(OC(=O)C)[H]
SPLASH splash10-066r-0910000000-a840905c1cd02281cbbe
Source of Spectrum SK-31-3425-3a
Synonyms Acetic acid [3,4,5-triacetyloxy-6-[[3-(4-methoxyphenyl)-4-oxo-1-benzopyran-7-yl]oxy]-2-oxanyl]methyl ester [3,4,5-triacetyloxy-6-[3-(4-methoxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl acetate [3,4,5-triacetoxy-6-[3-(4-methoxyphenyl)-4-oxo-chromen-7-yl]oxy-tetrahydropyran-2-yl]methyl acetate [3,4,5-triacetyloxy-6-[3-(4-methoxyphenyl)-4-oxidanylidene-chromen-7-yl]oxy-oxan-2-yl]methyl ethanoate
Wiley ID 882220