Allodihydrohistrionicotoxin
HIT214318970
sdf文件结构编辑类似物检索
HIT ID: HIT214318970
Cas No: 63983-63-1
分子式: C19H27NO
分子量: 285.431
常用名: Allodihydrohistrionicotoxin
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2R,6R,7S,8S)-7-[(1Z)-but-1-en-3-yn-1-yl]-2-(pent-4-yn-1-yl)-1-azaspiro[5.5]undecan-8-ol
IUPAC: (2R,6R,7S,8S)-7-[(1Z)-but-1-en-3-yn-1-yl]-2-(pent-4-yn-1-yl)-1-azaspiro[5.5]undecan-8-ol
SMILES: O[C@H]1CCC[C@]2(CCC[C@@H](CCCC#C)N2)[C@@H]1\C=C/C#C
SMILES: O[C@H]1CCC[C@]2(CCC[C@@H](CCCC#C)N2)[C@@H]1\C=C/C#C
InChI key: CMFZDHBDAODUDL-DTRHCTSISA-N
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TargetMol
SC
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