Chem
J-GLOBAL ID：200907060413543692   Nikkaji number：J2.482.337G

Gentioluteol

ゲンチオルテオール
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C21H26O8
Molecular formula furigana： C21-H26-O8
Molecular weight： 406.431
InChI： InChI=1S/C21H26O8/c1-26-16-7-12(4-5-15(16)23)6-14-10-29-20(21(14,25)11-22)13-8-17(27-2)19(24)18(9-13)28-3/h4-5,7-9,14,20,22-25H,6,10-11H2,1-3H3/t14-,20+,21+/m0/s1
InChI key： LCMWHJBXHUPSSX-LVXYXVKQSA-N
SMILES： COc1cc(C[C@H]2CO[C@H](c3cc(OC)c(O)c(OC)c3)[C@@]2(O)CO)ccc1O
Systematic name  (3)：
  • 4-[[(2R)-2α-(4-ヒドロキシ-3,5-ジメトキシフェニル)-3α-ヒドロキシ-3-(ヒドロキシメチル)テトラヒドロフラン-4β-イル]メチル]-2-メトキシフェノール
  • (2R,3S,4S)-2-(4-ヒドロキシ-3,5-ジメトキシフェニル)-4-[(4-ヒドロキシ-3-メトキシフェニル)メチル]-3-(ヒドロキシメチル)オキソラン-3-オール
  • (2R,3S,4S)-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-3-ol
Other name (3)：
  • 4-[[(2R)-2α-(4-Hydroxy-3,5-dimethoxyphenyl)-3α-hydroxy-3-(hydroxymethyl)tetrahydrofuran-4β-yl]methyl]-2-methoxyphenol
  • ゲンチオルテオール
  • Gentioluteol
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