Colladonin angelate
HIT105894549
sdf文件结构编辑类似物检索
HIT ID: HIT105894549
Cas No: 934714-19-9
分子式: C29H36O5
分子量: 464.602
常用名: Colladonin angelate
氢键受体数 (HBA): 3
氢键供体数 (HBD): 0
LogP: 6.548
IUPAC: 1,1,4a-trimethyl-6-methylidene-5-{[(2-oxo-2H-chromen-7-yl)oxy]methyl}-decahydronaphthalen-2-yl (2Z)-2-methylbut-2-enoate
IUPAC: 1,1,4a-trimethyl-6-methylidene-5-{[(2-oxo-2H-chromen-7-yl)oxy]methyl}-decahydronaphthalen-2-yl (2Z)-2-methylbut-2-enoate
SMILES: C\C=C(\C)C(=O)OC1CCC2(C)C(COc3ccc4ccc(=O)oc4c3)C(=C)CCC2C1(C)C
SMILES: C\C=C(\C)C(=O)OC1CCC2(C)C(COc3ccc4ccc(=O)oc4c3)C(=C)CCC2C1(C)C
InChI key: RXCOPEUPNGTASP-WSVATBPTSA-N
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