Chemical Compound

[(2S,3S,4R,5R)-3-(acetyloxy)-2-{[(2R,3S,4S,5R,6R)-6-[(acetyloxy)methyl]-4-{[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(1-hydroxy-2-oxopropyl)-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3-hydroxy-5-{[(2E)-3-(3-methoxy-4-methylphenyl)prop-2-enoyl]oxy}-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

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[(2S,3S,4R,5R)-3-(acetyloxy)-2-{[(2R,3S,4S,5R,6R)-6-[(acetyloxy)methyl]-4-{[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(1-hydroxy-2-oxopropyl)-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3-hydroxy-5-{[(2E)-3-(3-methoxy-4-methylphenyl)prop-2-enoyl]oxy}-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate 结构式
Primary record

[(2S,3S,4R,5R)-3-(acetyloxy)-2-{[(2R,3S,4S,5R,6R)-6-[(acetyloxy)methyl]-4-{[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(1-hydroxy-2-oxopropyl)-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3-hydroxy-5-{[(2E)-3-(3-methoxy-4-methylphenyl)prop-2-enoyl]oxy}-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
101751069
SMILES
CC1=C(C=C(C=C1)/C=C/C(=O)O[C@@H]2[C@H](O[C@@H]([C@@]([C@H]2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(C(=O)C)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)(O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O[C@]6([C@H]([C@@H]([C@H](O6)CO)O)OC(=O)C)COC(=O)/C=C/C7=CC(=C(C=C7)O)OC)COC(=O)C)OC
Canonical SMILES
COc1cc(/C=C/C(=O)O[C@@H]2[C@@H](COC(C)=O)O[C@H](O[C@]3(COC(=O)/C=C/c4ccc(O)c(OC)c4)O[C@H](CO)[C@@H](O)[C@@H]3OC(C)=O)[C@@](O)(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H]2O[C@@H]2O[C@H](C(O)C(C)=O)[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)ccc1C

名称与同义词

  • J1.944.346I
  • [(2S,3S,4R,5R)-3-(acetyloxy)-2-{[(2R,3S,4S,5R,6R)-6-[(acetyloxy)methyl]-4-{[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(1-hydroxy-2-oxopropyl)-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3-hydroxy-5-{[(2E)-3-(3-methoxy-4-methylphenyl)prop-2-enoyl]oxy}-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
  • 1-O-[1-(3-Methoxy-4-hydroxy-trans-cinnamoyloxymethyl)-2-O-acetyl-beta-D-arabinofuranosyl]-3-O-(4-O-beta-D-glucopyranosyl-6-acetyl-beta-D-glucopyranosyl)4-O-(3-methoxy-4-methyl-trans-cinnamoyl)-6-O-acetyl-alpha-D-glucopyranose-2-yl beta-D-glucopyranoside