Name: Ciclesonide
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT212083134
Cas No:126544-47-6
常用名:Ciclesonide
别名:环索奈德, Zetonna, RPR251526, Omnaris, Alvesco
别名:环索奈德, Zetonna, RPR251526, Omnaris, Alvesco
IUPAC:2-[(1S,2S,4R,6R,8S,9S,11S,12S,13R)-6-cyclohexyl-11-hydroxy-9,13-dimethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.0^{2,9}.0^{4,8}.0^{13,18}]icosa-14,17-dien-8-yl]-2-oxoethyl 2-methylpropanoate
IUPAC:2-[(1S,2S,4R,6R,8S,9S,11S,12S,13R)-6-cyclohexyl-11-hydroxy-9,13-dimethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.0^{2,9}.0^{4,8}.0^{13,18}]icosa-14,17-dien-8-yl]-2-oxoethyl 2-methylpropanoate
InChI key:LUKZNWIVRBCLON-GXOBDPJESA-N

分子式:C32H44O7
分子量:540.697
氢键供体数 (HBD):1
氢键受体数 (HBA):6
LogP:5.3232727
SMILES:[H][C@]1(O[C@@H]2C[C@@]3([H])[C@]4([H])CCC5=CC(=O)C=C[C@]5(C)[C@@]4([H])[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)COC(=O)C(C)C)C1CCCCC1 |c:15,t:11|
SMILES:[H][C@]1(O[C@@H]2C[C@@]3([H])[C@]4([H])CCC5=CC(=O)C=C[C@]5(C)[C@@]4([H])[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)COC(=O)C(C)C)C1CCCCC1 |c:15,t:11|

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