AL-8417
HIT212709943
sdf文件结构编辑类似物检索
HIT ID: HIT212709943
Cas No: 180472-20-2
分子式: C29H34O5
分子量: 462.586
常用名: AL-8417
氢键受体数 (HBA): 4
氢键供体数 (HBD): 1
LogP: 6.897189
IUPAC: 2-[(2R)-6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl]ethyl (2S)-2-(6-methoxynaphthalen-2-yl)propanoate
IUPAC: 2-[(2R)-6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl]ethyl (2S)-2-(6-methoxynaphthalen-2-yl)propanoate
SMILES: COc1ccc2cc(ccc2c1)[C@H](C)C(=O)OCC[C@@]1(C)CCc2c(C)c(O)c(C)c(C)c2O1
SMILES: COc1ccc2cc(ccc2c1)[C@H](C)C(=O)OCC[C@@]1(C)CCc2c(C)c(O)c(C)c(C)c2O1
InChI key: KYECYAFVFZRXIM-ADXZGYQBSA-N
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