Name: (1R,3aS,3bR,5aS,7S,9aS,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methyloct-7-yn-2-yl]-1,2,3,3a,3b,5,5a,6,7,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-4,2'-diazirin]-7-ol
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sdf 文件

结构编辑

类似物检索

HIT ID:HIT215290910
Cas No:2103360-95-6
常用名:(1R,3aS,3bR,5aS,7S,9aS,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methyloct-7-yn-2-yl]-1,2,3,3a,3b,5,5a,6,7,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-4,2'-diazirin]-7-ol
常用名:(1R,3aS,3bR,5aS,7S,9aS,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methyloct-7-yn-2-yl]-1,2,3,3a,3b,5,5a,6,7,8,9,9b,10,11-tetradecahydrospiro[cyclopenta[a]phenanthrene-4,2'-diazirin]-7-ol
IUPAC:(1R,3aS,3bR,5aS,7S,9aS,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methyloct-7-yn-2-yl]-1,2,3,3a,3b,5,5a,6,7,8,9,9a,9b,10,11,11a-hexadecahydrospiro[cyclopenta[a]phenanthrene-4,2'-diazirin]-7-ol
IUPAC:(1R,3aS,3bR,5aS,7S,9aS,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methyloct-7-yn-2-yl]-1,2,3,3a,3b,5,5a,6,7,8,9,9a,9b,10,11,11a-hexadecahydrospiro[cyclopenta[a]phenanthrene-4,2'-diazirin]-7-ol
InChI key:SQXRDZQIFZQIPT-OLGMYQPSSA-N

分子式:C28H44N2O
分子量:424.673
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]1(CC[C@@]2([H])[C@@]3([H])[C@]([H])(CC[C@]12C)[C@@]1(C)CC[C@H](O)C[C@]1([H])CC31N=N1)[C@H](C)CCCC(C)C#C
SMILES:[H][C@@]1(CC[C@@]2([H])[C@@]3([H])[C@]([H])(CC[C@]12C)[C@@]1(C)CC[C@H](O)C[C@]1([H])CC31N=N1)[C@H](C)CCCC(C)C#C

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