Chem
J-GLOBAL ID：202007011923078800
Nikkaji number：J3.750.770I
(5S,6R,7R,8S)-5,6,7-trihydroxy-4-oxo-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-8-yl 3-phenylpropanoate
(5S,6R,7R,8S)-5,6,7-トリヒドロキシ-4-オキソ-2-(2-フェニルエチル)-5,6,7,8-テトラヒドロクロメン-8-イル3-フェニルプロパノアート
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
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
Molecular formula： C26H26O7
Molecular formula furigana： C26-H26-O7
Molecular weight： 450.487
InChI：
InChI=1S/C26H26O7/c27-19-15-18(13-11-16-7-3-1-4-8-16)32-25-21(19)22(29)23(30)24(31)26(25)33-20(28)14-12-17-9-5-2-6-10-17/h1-10,15,22-24,26,29-31H,11-14H2/t22-,23+,24+,26-/m0/s1
InChI key：
ARCLLWUQDJXHSC-WSKLTFMVSA-N
SMILES：
[C@@H]1([C@@H](c2c([C@@H]([C@H]1O)O)c(=O)cc(o2)CCc1ccccc1)OC(=O)CCc1ccccc1)O
Systematic name (3)：
- (5S,6R,7R,8S)-8-[(3-フェニルプロパノイル)オキシ]-5,6,7-トリヒドロキシ-5,6,7,8-テトラヒドロ-2-(2-フェニルエチル)-4H-1-ベンゾピラン-4-オン
- (5S,6R,7R,8S)-5,6,7-トリヒドロキシ-4-オキソ-2-(2-フェニルエチル)-5,6,7,8-テトラヒドロ-4H-クロメン-8-イル3-フェニルプロパノアート
- (5S,6R,7R,8S)-5,6,7-trihydroxy-4-oxo-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-8-yl 3-phenylpropanoate
- (5S,6R,7R,8S)-5,6,7-トリヒドロキシ-4-オキソ-2-(2-フェニルエチル)-5,6,7,8-テトラヒドロクロメン-8-イル3-フェニルプロパノアート
- (5S,6R,7R,8S)-5,6,7-trihydroxy-4-oxo-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-8-yl 3-phenylpropanoate
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