Name: Yunnancoronarin A
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT213885608
Cas No:162762-93-8
常用名:Yunnancoronarin A
IUPAC:(1R,4S,4aR,8aS)-4-[(1E)-2-(furan-3-yl)ethenyl]-4a,8,8-trimethyl-3-methylidene-decahydronaphthalen-1-ol
IUPAC:(1R,4S,4aR,8aS)-4-[(1E)-2-(furan-3-yl)ethenyl]-4a,8,8-trimethyl-3-methylidene-decahydronaphthalen-1-ol
InChI key:UTIGHTZWXIGRIJ-JEQJTPLUSA-N

分子式:C20H28O2
分子量:300.442
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC1(C)CCC[C@]2(C)[C@@H](\C=C\c3ccoc3)C(=C)C[C@@H](O)[C@@H]12
SMILES:CC1(C)CCC[C@]2(C)[C@@H](\C=C\c3ccoc3)C(=C)C[C@@H](O)[C@@H]12

Yunnancoronarin A shows cytotoxicity against the lung adenocarcinoma cells A549 and leukemia cells K562, with the IC(50) value of 2.20 microM.

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