Chemical Compound

(10R)-2,2,5abeta,9beta-Tetramethyl-3,4,5,5a,6,7,8,9-octahydro-2H-3beta,9abeta-methano-1-benzooxepin-4alpha,5alpha,6beta,10-tetraol 4-[(E)-3-phenylpropenoate]5-benzoate 6-acetate

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(10R)-2,2,5abeta,9beta-Tetramethyl-3,4,5,5a,6,7,8,9-octahydro-2H-3beta,9abeta-methano-1-benzooxepin-4alpha,5alpha,6beta,10-tetraol 4-[(E)-3-phenylpropenoate]5-benzoate 6-acetate 结构式
Primary record

(10R)-2,2,5abeta,9beta-Tetramethyl-3,4,5,5a,6,7,8,9-octahydro-2H-3beta,9abeta-methano-1-benzooxepin-4alpha,5alpha,6beta,10-tetraol 4-[(E)-3-phenylpropenoate]5-benzoate 6-acetate

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
25017176
SMILES
C[C@@H]1CC[C@@H]([C@@]2([C@]13[C@@H]([C@@H]([C@@H]([C@@H]2OC(=O)C4=CC=CC=C4)OC(=O)/C=C/C5=CC=CC=C5)C(O3)(C)C)O)C)OC(=O)C
Canonical SMILES
CC(=O)O[C@H]1CC[C@@H](C)[C@]23OC(C)(C)[C@H]([C@H](OC(=O)/C=C/c4ccccc4)[C@H](OC(=O)c4ccccc4)[C@]12C)[C@H]3O

名称与同义词

  • CHEMBL446222
  • J2.634.632K
  • [acetoxy-hydroxy-tetramethyl-[(E)-3-phenylprop-2-enoyl]oxy-[?]yl] benzoate
  • (10R)-2,2,5abeta,9beta-Tetramethyl-3,4,5,5a,6,7,8,9-octahydro-2H-3beta,9abeta-methano-1-benzooxepin-4alpha,5alpha,6beta,10-tetraol 4-[(E)-3-phenylpropenoate]5-benzoate 6-acetate
  • (1R)-3alpha-(Cinnamoyloxy)-4alpha-(benzoyloxy)-4abeta,8beta,10,10-tetramethyl-5beta-acetoxy-8aalpha,2alpha-(epoxymethano)decahydronaphthalene-1alpha-ol
  • (1S,2R,5S,6S,7R,8S,9S,12R)-5-(acetyloxy)-12-hydroxy-2,6,10,10-tetramethyl-8-{[(2E)-3-phenylprop-2-enoyl]oxy}-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl benzoate