Chem
J-GLOBAL ID:200907032956376768   Nikkaji number:J2.771.226F

3-[(2S,3S)-2,3-Dihydro-6-hydroxy-2-(1-hydroxy-1-methylethyl)-4-methoxy-7-(1-oxo-3-phenylpropyl)benzofuran-3-yl]-4-hydroxybenzoic acid methyl ester

3-[(2S,3S)-2,3-ジヒドロ-6-ヒドロキシ-2-(1-ヒドロキシ-1-メチルエチル)-4-メトキシ-7-(1-オキソ-3-フェニルプロピル)ベンゾフラン-3-イル]-4-ヒドロキシ安息香酸メチル
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: C29H30O8
Molecular formula furigana: C29-H30-O8
Molecular weight: 506.551
InChI: InChI=1S/C29H30O8/c1-29(2,34)27-23(18-14-17(28(33)36-4)11-13-19(18)30)25-22(35-3)15-21(32)24(26(25)37-27)20(31)12-10-16-8-6-5-7-9-16/h5-9,11,13-15,23,27,30,32,34H,10,12H2,1-4H3/t23-,27-/m0/s1
InChI key: KGNWKZGVYSTAOX-HOFKKMOUSA-N
SMILES: COC(=O)c1ccc(O)c(c1)[C@@H]1[C@H](Oc2c1c(OC)cc(O)c2C(=O)CCc1ccccc1)C(C)(C)O
Systematic name  (3):
  • 3-[(2S,3S)-2,3-ジヒドロ-6-ヒドロキシ-2-(1-ヒドロキシ-1-メチルエチル)-4-メトキシ-7-(1-オキソ-3-フェニルプロピル)ベンゾフラン-3-イル]-4-ヒドロキシ安息香酸メチル
  • メチル 4-ヒドロキシ-3-[(2S,3S)-6-ヒドロキシ-2-(2-ヒドロキシプロパン-2-イル)-4-メトキシ-7-(3-フェニルプロパノイル)-2,3-ジヒドロ-1-ベンゾフラン-3-イル]ベンゾアート
  • methyl 4-hydroxy-3-[(2S,3S)-6-hydroxy-2-(2-hydroxypropan-2-yl)-4-methoxy-7-(3-phenylpropanoyl)-2,3-dihydro-1-benzofuran-3-yl]benzoate
Other name (1):
  • 3-[(2S,3S)-2,3-Dihydro-6-hydroxy-2-(1-hydroxy-1-methylethyl)-4-methoxy-7-(1-oxo-3-phenylpropyl)benzofuran-3-yl]-4-hydroxybenzoic acid methyl ester
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