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8-[(E)-3'-Phenylprop-2'-en-1'-oxo]-(2R,3S)-2-(3",5"-dihydroxyphenyl)-3,4-dihydro-2H-[2]-benzopyran-5-methoxy-3,7-diol
SpectraBase Compound ID 6lCY56QsGKb
InChI InChI=1S/C25H22O7/c1-31-22-13-20(29)23(19(28)8-7-14-5-3-2-4-6-14)25-18(22)12-21(30)24(32-25)15-9-16(26)11-17(27)10-15/h2-11,13,21,24,26-27,29-30H,12H2,1H3/b8-7+/t21-,24+/m0/s1
InChIKey BARBUPBDCQNXQJ-OGCRQELKSA-N
Mol Weight 434.44 g/mol
Molecular Formula C25H22O7
Exact Mass 434.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HD9H3wJFGpd
Name 8-[(E)-3'-Phenylprop-2'-en-1'-oxo]-(2R,3S)-2-(3",5"-dihydroxyphenyl)-3,4-dihydro-2H-[2]-benzopyran-5-methoxy-3,7-diol
Alternate Name(s) (E)-1-[(2R,3S)-2-(3,5-dihydroxyphenyl)-3,7-dihydroxy-5-methoxy-3,4-dihydro-2H-1-benzopyran-8-yl]-3-phenyl-2-propen-1-one (E)-1-[(2R,3S)-2-(3,5-dihydroxyphenyl)-3,7-dihydroxy-5-methoxy-3,4-dihydro-2H-chromen-8-yl]-3-phenylprop-2-en-1-one (E)-1-[(2R,3S)-2-[3,5-bis(oxidanyl)phenyl]-5-methoxy-3,7-bis(oxidanyl)-3,4-dihydro-2H-chromen-8-yl]-3-phenyl-prop-2-en-1-one
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Formula C25H22O7
InChI InChI=1S/C25H22O7/c1-31-22-13-20(29)23(19(28)8-7-14-5-3-2-4-6-14)25-18(22)12-21(30)24(32-25)15-9-16(26)11-17(27)10-15/h2-11,13,21,24,26-27,29-30H,12H2,1H3/b8-7+/t21-,24+/m0/s1
InChIKey BARBUPBDCQNXQJ-OGCRQELKSA-N
Molecular Weight 434.444 g/mol
SMILES Oc1c(c2O[C@](c3cc(cc(c3)O)O)([C@](Cc2c(c1)OC)(O)[H])[H])C(\C=C\c1ccccc1)=O
SPLASH splash10-003r-0950100000-b4c324bf1533fa87742b
Source of Spectrum G4-72-801-1a
Wiley ID 1702131