Chem
J-GLOBAL ID：200907062494066918   Nikkaji number：J2.012.540C

10-Cinnamoyloxyoleoside 7-methyl ester

10-シンナモイルオキシオレオシド7-メチルエステル
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： C26H30O13
Molecular formula furigana： C26-H30-O13
Molecular weight： 550.513
InChI： InChI=1S/C26H30O13/c1-35-20(29)11-16-15(9-10-36-19(28)8-7-14-5-3-2-4-6-14)25(37-13-17(16)24(33)34)39-26-23(32)22(31)21(30)18(12-27)38-26/h2-9,13,16,18,21-23,25-27,30-32H,10-12H2,1H3,(H,33,34)/b8-7?,15-9+/t16-,18+,21+,22-,23+,25-,26-/m0/s1
InChI key： JGHUOJAZXGSFRI-IYOYWTFLSA-N
SMILES： COC(=O)C[C@H]1/C(=C\COC(=O)C=Cc2ccccc2)/[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C1C(=O)O
Systematic name  (3)：
  • (5E,6S)-5,6-ジヒドロ-4β-(メトキシカルボニルメチル)-5-[2-(3-フェニルアクリロイルオキシ)エチリデン]-6α-(β-D-グルコピラノシルオキシ)-4H-ピラン-3-カルボン酸
  • (2S,3E,4S)-4-(2-メトキシ-2-オキソエチル)-3-{2-[(3-フェニルプロパ-2-エノイル)オキシ]エチリデン}-2-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-3,4-ジヒドロ-2H-ピラン-5-カルボン酸
  • (2S,3E,4S)-4-(2-methoxy-2-oxoethyl)-3-{2-[(3-phenylprop-2-enoyl)oxy]ethylidene}-2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-carboxylic acid
Other name (3)：
  • (5E,6S)-5,6-Dihydro-4β-(methoxycarbonylmethyl)-5-[2-(3-phenylacryloyloxy)ethylidene]-6α-(β-D-glucopyranosyloxy)-4H-pyran-3-carboxylic acid
  • 10-Cinnamoyloxyoleoside 7-methyl ester
  • 10-シンナモイルオキシオレオシド7-メチルエステル
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