Name: Alstoyunine E
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214317142
Cas No:1188932-15-1
常用名:Alstoyunine E
IUPAC:(1R,10S,12R,13E,16S,17S,18R)-13-ethylidene-15-oxo-8,15lambda5-diazahexacyclo[14.2.1.0^{1,9}.0^{2,7}.0^{10,15}.0^{12,17}]nonadeca-2(7),3,5,8-tetraen-18-yl acetate
IUPAC:(1R,10S,12R,13E,16S,17S,18R)-13-ethylidene-15-oxo-8,15lambda5-diazahexacyclo[14.2.1.0^{1,9}.0^{2,7}.0^{10,15}.0^{12,17}]nonadeca-2(7),3,5,8-tetraen-18-yl acetate
InChI key:SYZGOUOZLCZRJD-TZUVUNOXSA-N

分子式:C21H22N2O3
分子量:350.418
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]12C[C@]34[C@H](OC(C)=O)[C@@]1([H])[C@@]1([H])C[C@@]([H])(C3=Nc3ccccc43)N2(=O)C\C1=C\C |c:18,TLB:4:3:24:9.11.13,4:9:24:3.16.2,4:9:14.13:27.26,16:14:1.9:27.26,2:1:14.13:27.26,23:3:24:9.11.13,THB:13:14:2:4.9,27:11:24:3.16.2|
SMILES:[H][C@]12C[C@]34[C@H](OC(C)=O)[C@@]1([H])[C@@]1([H])C[C@@]([H])(C3=Nc3ccccc43)N2(=O)C\C1=C\C |c:18,TLB:4:3:24:9.11.13,4:9:24:3.16.2,4:9:14.13:27.26,16:14:1.9:27.26,2:1:14.13:27.26,23:3:24:9.11.13,THB:13:14:2:4.9,27:11:24:3.16.2|

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