Clearanol C
HIT212525612
sdf文件结构编辑类似物检索
HIT ID: HIT212525612
Cas No: 1384260-56-3
分子式: C13H14O4
分子量: 234.251
常用名: Clearanol C
氢键受体数 (HBA): 3
氢键供体数 (HBD): 1
LogP: 3.104
IUPAC: (4S)-8-hydroxy-6-methoxy-4,5-dimethyl-3-methylidene-3,4-dihydro-1H-2-benzopyran-1-one
IUPAC: (4S)-8-hydroxy-6-methoxy-4,5-dimethyl-3-methylidene-3,4-dihydro-1H-2-benzopyran-1-one
SMILES: COc1cc(O)c2C(=O)OC(=C)[C@@H](C)c2c1C
SMILES: COc1cc(O)c2C(=O)OC(=C)[C@@H](C)c2c1C
InChI key: CIGSWLXZMSXAAE-ZCFIWIBFSA-N
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