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3,5-DIHYDROXYBIPHENYL-4-C-BETA-GLUCOPYRANOSIDE;CALOPHYMEMBRANSIDE_A
SpectraBase Compound ID GmtEYkyXXWn
InChI InChI=1S/C18H20O7/c19-8-13-15(22)16(23)17(24)18(25-13)14-11(20)6-10(7-12(14)21)9-4-2-1-3-5-9/h1-7,13,15-24H,8H2/t13-,15-,16+,17-,18+/m0/s1
InChIKey XFERALHYVMKHDH-XEIOYGOASA-N
Mol Weight 348.35 g/mol
Molecular Formula C18H20O7
Exact Mass 348.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 60jHFvLDidW
Name 2-(2,6-dihydroxy-4-phenyl-phenyl)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O7
InChI InChI=1S/C18H20O7/c19-8-13-15(22)16(23)17(24)18(25-13)14-11(20)6-10(7-12(14)21)9-4-2-1-3-5-9/h1-7,13,15-24H,8H2/t13-,15-,16+,17-,18+/m0/s1
InChIKey XFERALHYVMKHDH-XEIOYGOASA-N
Molecular Weight 348.351 g/mol
SMILES Oc1cc(cc(c1[C@@]1([C@]([C@@]([C@]([C@@](O1)(CO)[H])(O)[H])(O)[H])(O)[H])[H])O)-c1ccccc1
SPLASH splash10-0fvi-0391000000-8a78ac6d992eb82ff4d0
Source of Spectrum X2-68-1516-4
Synonyms 2-(2,6-dihydroxy-4-phenyl-phenyl)-6-methylol-tetrahydropyran-3,4,5-triol 2-(2,6-dihydroxy-4-phenylphenyl)-6-(hydroxymethyl)oxane-3,4,5-triol 2-[2,6-bis(oxidanyl)-4-phenyl-phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
Wiley ID 1609729