Chemical Compound

(1S,2S,5S,6S,7S,8R,9R,12R)-12-(acetyloxy)-6-[(acetyloxy)methyl]-7-(benzoyloxy)-2-hydroxy-2,10,10-trimethyl-8-[(2-methylbutanoyl)oxy]-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl benzoate

(1S,2S,5S,6S,7S,8R,9R,12R)-12-(acetyloxy)-6-[(acetyloxy)methyl]-7-(benzoyloxy)-2-hydroxy-2,10,10-trimethyl-8-[(2-methylbutanoyl)oxy]-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl benzoate 结构式
Primary record

(1S,2S,5S,6S,7S,8R,9R,12R)-12-(acetyloxy)-6-[(acetyloxy)methyl]-7-(benzoyloxy)-2-hydroxy-2,10,10-trimethyl-8-[(2-methylbutanoyl)oxy]-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl benzoate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
14705555
SMILES
CCC(C)C(=O)O[C@@H]1[C@@H]2[C@H]([C@@]3([C@@](CC[C@@H]([C@]3([C@@H]1OC(=O)C4=CC=CC=C4)COC(=O)C)OC(=O)C5=CC=CC=C5)(C)O)OC2(C)C)OC(=O)C
Canonical SMILES
CCC(C)C(=O)O[C@@H]1[C@@H]2[C@@H](OC(C)=O)[C@@]3(OC2(C)C)[C@@](COC(C)=O)([C@@H](OC(=O)c2ccccc2)CC[C@]3(C)O)[C@@H]1OC(=O)c1ccccc1

名称与同义词

  • J341.589I
  • (1S,2S,5S,6S,7S,8R,9R,12R)-12-(acetyloxy)-6-[(acetyloxy)methyl]-7-(benzoyloxy)-2-hydroxy-2,10,10-trimethyl-8-[(2-methylbutanoyl)oxy]-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl benzoate
  • (3R,10R)-5abeta-(Acetoxymethyl)-2,2,9-trimethyl-octahydro-3beta,9abeta-methano-2H-1-benzoxepin-4beta,5beta,6beta,9alpha,10-pentol 4-(2-methylbutyrate)5,6-dibenzoate 10-acetate