Primary record
(3S,10R)-3,4,5,5a,6,7,8,9-Octahydro-2,2,9beta-trimethyl-5abeta-[[(2-methylbutyryl)oxy]methyl]-2H-3beta,9abeta-methano-1-benzoxepin-4alpha,5beta,6beta,7beta,9alpha,10-hexol 4-(2-methylbutanoate)5-benzoate 6-acetate
- 库存
- 550 克
- 纯度
- 98.1 %
化合物标识与属性
- PubChem CID
- 10722886
- SMILES
- CCC(C)C(=O)OC[C@@]12[C@H]([C@H](C[C@]([C@@]13[C@@H]([C@@H]([C@@H]([C@H]2OC(=O)C4=CC=CC=C4)OC(=O)C(C)CC)C(O3)(C)C)O)(C)O)O)OC(=O)C
- Canonical SMILES
- CCC(C)C(=O)OC[C@]12[C@H](OC(=O)c3ccccc3)[C@@H](OC(=O)C(C)CC)[C@@H]3[C@@H](O)[C@]1(OC3(C)C)[C@@](C)(O)C[C@H](O)[C@@H]2OC(C)=O
名称与同义词
- CHEMBL136747
- CID10722886
- CID 10722886
- J1.033.479I
- (1S,2S,4S,5R,6S,7S,8S,9S,12R)-5-(acetyloxy)-2,4,12-trihydroxy-2,10,10-trimethyl-8-[(2-methylbutanoyl)oxy]-6-{[(2-methylbutanoyl)oxy]methyl}-11-oxatricyclo[7.2.1.01,6]dodecan-7-yl benzoate
- (3S,10R)-3,4,5,5a,6,7,8,9-Octahydro-2,2,9beta-trimethyl-5abeta-[[(2-methylbutyryl)oxy]methyl]-2H-3beta,9abeta-methano-1-benzoxepin-4alpha,5beta,6beta,7beta,9alpha,10-hexol 4-(2-methylbutanoate)5-benzoate 6-acetate
- Benzoic acid (1R)-3alpha-(2-methylbutyryloxy)-5beta-acetoxy-4abeta-[(2-methylbutyryloxy)methyl]-1alpha,6beta,8alpha-trihydroxy-8,10,10-trimethyl-8aalpha,2alpha-(epoxymethano)decalin-4beta-yl ester