Chemical Compound

2,2-bis({2,3,4-trihydroxy-5-[3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1-yl})acetic acid

2,2-bis({2,3,4-trihydroxy-5-[3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1-yl})acetic acid 结构式
Primary record

2,2-bis({2,3,4-trihydroxy-5-[3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1-yl})acetic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177398913
SMILES
C1=CC(=CC=C1/C=C/C(=C\2/C(=O)C(C(=O)C(=C2O)C(C(=O)O)C3=C(/C(=C(/O)\C=C\C4=CC=C(C=C4)O)/C(=O)C(C3=O)(O)[C@@H]5O[C@@H]([C@H]([C@@H]([C@H]5O)O)O)CO)O)(O)[C@@H]6O[C@@H]([C@H]([C@@H]([C@H]6O)O)O)CO)/O)O
Canonical SMILES
O=C(O)C(C1=C(O)/C(=C(O)\C=C\c2ccc(O)cc2)C(=O)C(O)([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C1=O)C1=C(O)/C(=C(O)\C=C\c2ccc(O)cc2)C(=O)C(O)([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C1=O

名称与同义词

  • Precarthamin
  • J675.898C
  • 2,2 -(2-Oxo-2-hydroxyethylidene)bis[3,4,5-trihydroxy-4-beta-D-glucopyranosyl-6-[3-(4-hydroxyphenyl)propenoyl]-2,5-cyclohexadien-1-one]
  • 2,2-bis({2,3,4-trihydroxy-5-[3-(4-hydroxyphenyl)prop-2-enoyl]-6-oxo-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]cyclohexa-1,4-dien-1-yl})acetic acid