Ajudecunoid A
HIT217584496
sdf文件结构编辑类似物检索
HIT ID: HIT217584496
Cas No: 124961-67-7
分子式: C25H36O6
分子量: 432.557
常用名: Ajudecunoid A
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: [(1R,4aR,5S,6R,8S,8aR)-8-hydroxy-5,6-dimethyl-5-[2-(5-oxo-2,5-dihydrofuran-3-yl)ethyl]-octahydro-2H-spiro[naphthalene-1,2'-oxiran]-8a-yl]methyl (2E)-2-methylbut-2-enoate
IUPAC: [(1R,4aR,5S,6R,8S,8aR)-8-hydroxy-5,6-dimethyl-5-[2-(5-oxo-2,5-dihydrofuran-3-yl)ethyl]-octahydro-2H-spiro[naphthalene-1,2'-oxiran]-8a-yl]methyl (2E)-2-methylbut-2-enoate
SMILES: [H][C@]12CCC[C@]3(CO3)[C@]1(COC(=O)C(\C)=C\C)[C@@H](O)C[C@@H](C)[C@]2(C)CCC1=CC(=O)OC1
SMILES: [H][C@]12CCC[C@]3(CO3)[C@]1(COC(=O)C(\C)=C\C)[C@@H](O)C[C@@H](C)[C@]2(C)CCC1=CC(=O)OC1
InChI key: OPIBUIPAAPHGEN-DONKYKGPSA-N
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