Dalvastatin
HIT212711460
sdf文件结构编辑类似物检索
HIT ID: HIT212711460
Cas No: 132100-55-1
分子式: C24H31FO3
分子量: 386.507
常用名: Dalvastatin
氢键受体数 (HBA): 2
氢键供体数 (HBD): 1
LogP: 5.0103097
IUPAC: (4S,6R)-6-[(1E)-2-[2-(4-fluoro-3-methylphenyl)-4,4,6,6-tetramethylcyclohex-1-en-1-yl]ethenyl]-4-hydroxyoxan-2-one
IUPAC: (4S,6R)-6-[(1E)-2-[2-(4-fluoro-3-methylphenyl)-4,4,6,6-tetramethylcyclohex-1-en-1-yl]ethenyl]-4-hydroxyoxan-2-one
SMILES: Cc1cc(ccc1F)C1=C(\C=C\[C@H]2C[C@H](O)CC(=O)O2)C(C)(C)CC(C)(C)C1 |c:9|
SMILES: Cc1cc(ccc1F)C1=C(\C=C\[C@H]2C[C@H](O)CC(=O)O2)C(C)(C)CC(C)(C)C1 |c:9|
InChI key: VDSBXXDKCUBMQC-VUOWKATKSA-N
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