Chemical Compound

(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,19R,20S,21S)-4,19,20-tris(acetyloxy)-6-(furan-3-yl)-12,21-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-16-yl 2-methylpropanoate

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(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,19R,20S,21S)-4,19,20-tris(acetyloxy)-6-(furan-3-yl)-12,21-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-16-yl 2-methylpropanoate 结构式
Primary record

(1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,19R,20S,21S)-4,19,20-tris(acetyloxy)-6-(furan-3-yl)-12,21-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-16-yl 2-methylpropanoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177478365
SMILES
CC(C)C(=O)OC1[C@@]2([C@@H]3C[C@H]([C@@]4([C@@H]([C@@]3(CO1)[C@H]([C@H]([C@H]2O)OC(=O)C)OC(=O)C)C(=O)[C@@H]([C@@]5([C@]46[C@H](O6)C[C@H]5C7=COC=C7)C)OC(=O)C)C)O)C
Canonical SMILES
CC(=O)O[C@H]1[C@@H](O)[C@]2(C)C(OC(=O)C(C)C)OC[C@]3([C@H]4C(=O)[C@H](OC(C)=O)[C@@]5(C)[C@H](c6ccoc6)C[C@H]6O[C@]65[C@]4(C)[C@H](O)C[C@@H]23)[C@H]1OC(C)=O

名称与同义词

  • J2.460.729A
  • 29-Deacyl-29-(2-methylpropanoyl)-3-O-acetyl-1,12-diacetyltrichilin B
  • (1S,2R,4R,5R,6S,8R,10S,11S,12R,14R,15R,19R,20S,21S)-4,19,20-tris(acetyloxy)-6-(furan-3-yl)-12,21-dihydroxy-5,11,15-trimethyl-3-oxo-9,17-dioxahexacyclo[13.3.3.01,14.02,11.05,10.08,10]henicosan-16-yl 2-methylpropanoate
  • (4R,13alpha,17alpha)-4,8-Dimethyl-11-oxo-14beta,15beta:21,23-diepoxy-19,4beta-(epoxymethano)-24-nor-5alpha-chola-20,22-diene-1alpha,2alpha,3alpha,7alpha,12alpha,26-hexaol 1,2,12-triacetate 26-(2-methylpropanoate)