Methyl 7β,15-dihydroxydehydroabietate
HIT214312050
sdf文件结构编辑类似物检索
HIT ID: HIT214312050
Cas No: 107752-10-3
分子式: C21H30O4
分子量: 346.467
常用名: Methyl 7β,15-dihydroxydehydroabietate
常用名: Methyl 7β,15-dihydroxydehydroabietate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: methyl (1R,4aS,9S,10aR)-9-hydroxy-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylate
IUPAC: methyl (1R,4aS,9S,10aR)-9-hydroxy-7-(2-hydroxypropan-2-yl)-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylate
SMILES: COC(=O)[C@]1(C)CCC[C@@]2(C)[C@H]1C[C@H](O)c1cc(ccc21)C(C)(C)O
SMILES: COC(=O)[C@]1(C)CCC[C@@]2(C)[C@H]1C[C@H](O)c1cc(ccc21)C(C)(C)O
InChI key: MRTXWRPVFGYIEY-XWDORNJCSA-N
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