Name: Anordiol
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212676108
Cas No:1045-29-0
常用名:Anordiol
别名:H241, H 241, AF-45, AF45, AF 45
IUPAC:(1S,2S,4R,6S,9R,10S,13R,14S)-4,13-diethynyl-2,14-dimethyltetracyclo[7.7.0.0^{2,6}.0^{10,14}]hexadecane-4,13-diol
IUPAC:(1S,2S,4R,6S,9R,10S,13R,14S)-4,13-diethynyl-2,14-dimethyltetracyclo[7.7.0.0^{2,6}.0^{10,14}]hexadecane-4,13-diol
InChI key:HUUUMTTWAPMBMU-ZBJWQKIUSA-N

分子式:C22H30O2
分子量:326.48
氢键供体数 (HBD):2
氢键受体数 (HBA):2
LogP:3.0628917
SMILES:[H][C@]12C[C@@](O)(C[C@]1(C)[C@@]1([H])CC[C@@]3(C)[C@@]([H])(CC[C@@]3(O)C#C)[C@]1([H])CC2)C#C
SMILES:[H][C@]12C[C@@](O)(C[C@]1(C)[C@@]1([H])CC[C@@]3(C)[C@@]([H])(CC[C@@]3(O)C#C)[C@]1([H])CC2)C#C

Anordiol is an antiestrogen with estrogenic activity. It also is known to inhibit fertility.

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