Name: Detajmium bitartrate
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214317902
Cas No:33774-52-6
常用名:Detajmium bitartrate
别名:Tachmalcor
IUPAC:(1R,9R,10S,12R,13S,14R,16S,17S)-15-[3-(diethylamino)-2-hydroxypropyl]-13-ethyl-14,18-dihydroxy-8-methyl-8,15-diazahexacyclo[14.2.1.0^{1,9}.0^{2,7}.0^{10,15}.0^{12,17}]nonadeca-2(7),3,5-trien-15-ium (2S,3R)-3-carboxy-2,3-dihydroxypropanoate
IUPAC:(1R,9R,10S,12R,13S,14R,16S,17S)-15-[3-(diethylamino)-2-hydroxypropyl]-13-ethyl-14,18-dihydroxy-8-methyl-8,15-diazahexacyclo[14.2.1.0^{1,9}.0^{2,7}.0^{10,15}.0^{12,17}]nonadeca-2(7),3,5-trien-15-ium (2S,3R)-3-carboxy-2,3-dihydroxypropanoate
InChI key:NXAWWUAMFJNVMF-APUNSANTSA-M

分子式:C31H47N3O9
分子量:605.729
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:O[C@H]([C@H](O)C([O-])=O)C(O)=O.[H][C@]12C[C@]34C(O)[C@@]1([H])[C@@]1([H])C[C@@]([H])([C@]3([H])N(C)c3ccccc43)[N+]2(CC(O)CN(CC)CC)[C@H](O)[C@H]1CC |TLB:14:13:33:16.18.20,14:16:33:13.23.12,14:16:21.20:45.43,23:21:11.16:45.43,12:11:21.20:45.43,43:33:13.23.12:16.18.20,44:43:11.16:21.20,25:23:33:16.18.20,32:13:33:16.18.20,THB:34:33:13.23.12:16.18.20,45:18:33:13.23.12,46:45:11.16:21.20|
SMILES:O[C@H]([C@H](O)C([O-])=O)C(O)=O.[H][C@]12C[C@]34C(O)[C@@]1([H])[C@@]1([H])C[C@@]([H])([C@]3([H])N(C)c3ccccc43)[N+]2(CC(O)CN(CC)CC)[C@H](O)[C@H]1CC |TLB:14:13:33:16.18.20,14:16:33:13.23.12,14:16:21.20:45.43,23:21:11.16:45.43,12:11:21.20:45.43,43:33:13.23.12:16.18.20,44:43:11.16:21.20,25:23:33:16.18.20,32:13:33:16.18.20,THB:34:33:13.23.12:16.18.20,45:18:33:13.23.12,46:45:11.16:21.20|

市场产品/服务共显示1个结果

您无法确定哪种化合物库最适合您的项目？或者您需要定制解决方案？Anymole随时为您提供帮助。

电话：400820-0310

合作：info@screeningcompound.com

技术支持：tech@screeningcompound.com

客服：service@screeningcompound.com

正在加载 ~