Chemical Compound

(alphaR)-alpha-[(E)-3-[[(2S)-3beta-[[(R)-2-(3,4-Dihydroxyphenyl)-1-(ethoxycarbonyl)ethoxy]carbonyl]-2alpha-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydrobenzofuran]-4-yl]-1-oxo-2-propenyloxy]-3,4-dihydroxybenzenepropionic acid

(alphaR)-alpha-[(E)-3-[[(2S)-3beta-[[(R)-2-(3,4-Dihydroxyphenyl)-1-(ethoxycarbonyl)ethoxy]carbonyl]-2alpha-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydrobenzofuran]-4-yl]-1-oxo-2-propenyloxy]-3,4-dihydroxybenzenepropionic acid 结构式
Primary record

(alphaR)-alpha-[(E)-3-[[(2S)-3beta-[[(R)-2-(3,4-Dihydroxyphenyl)-1-(ethoxycarbonyl)ethoxy]carbonyl]-2alpha-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydrobenzofuran]-4-yl]-1-oxo-2-propenyloxy]-3,4-dihydroxybenzenepropionic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
101397603
SMILES
CCOC(=O)[C@@H](CC1=CC(=C(C=C1)O)O)OC(=O)[C@@H]2[C@H](OC3=C(C=CC(=C23)/C=C/C(=O)O[C@H](CC4=CC(=C(C=C4)O)O)C(=O)O)O)C5=CC(=C(C=C5)O)O
Canonical SMILES
CCOC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)[C@H]1c2c(/C=C/C(=O)O[C@H](Cc3ccc(O)c(O)c3)C(=O)O)ccc(O)c2O[C@@H]1c1ccc(O)c(O)c1

名称与同义词

  • 9'''-ethyl lithospermate B
  • J2.293.007I
  • (2R)-3-(3,4-dihydroxyphenyl)-2-{[(2E)-3-[(2S,3S)-2-(3,4-dihydroxyphenyl)-3-({[(2R)-3-(3,4-dihydroxyphenyl)-1-ethoxy-1-oxopropan-2-yl]oxy}carbonyl)-7-hydroxy-2,3-dihydro-1-benzofuran-4-yl]prop-2-enoyl]oxy}propanoic acid
  • (alphaR)-alpha-[(E)-3-[[(2S)-3beta-[[(R)-2-(3,4-Dihydroxyphenyl)-1-(ethoxycarbonyl)ethoxy]carbonyl]-2alpha-(3,4-dihydroxyphenyl)-7-hydroxy-2,3-dihydrobenzofuran]-4-yl]-1-oxo-2-propenyloxy]-3,4-dihydroxybenzenepropionic acid