HRID1944938

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(S(=O)(=O)CCCCCCCCCCCO)cc23)c1

HCID66988573

未命名化合物

结构：COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(S(=O)(=O)c4cccc(C(=O)NCCCCCCCC=O)c4)cc23)c1

HCID86659091

未命名化合物

PRODUCTS

生成物

HCID86659100

未命名化合物

PROCEDURE

实验过程

The title compound was synthesized in a manner analogous to that described for Intermediate 112, using Intermediate 61 as a substrate. ES/MS calcd. for C29H38N3O5S+ 540.3. Found m/z=540.4 (M+H)+.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7e00bf81c11c4420bba4ddae1fbb9c83
来源数据集: uspto-grants-2013_03
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08394829B2
来源说明: uspto-grants-2013_03

反应 SMILES

COC1C=C(NC2C3C(=C(C)C=C(S(C4C=CC=C(C(=O)NCCCCCCCC=O)C=4)(=O)=O)C=3)N=CC=2C(N)=O)C=CC=1.[OH:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH2:53][CH2:54][CH2:55][CH2:56][S:57]([C:60]1[CH:61]=[C:62]2[C:67](=[C:68]([CH3:70])[CH:69]=1)[N:66]=[CH:65][C:64]([C:71]([NH2:73])=[O:72])=[C:63]2[NH:74][C:75]1[CH:80]=[CH:79][CH:78]=[C:77]([O:81][CH3:82])[CH:76]=1)(=[O:59])=[O:58]>>[CH3:82][O:81][C:77]1[CH:76]=[C:75]([NH:74][C:63]2[C:62]3[C:67](=[C:68]([CH3:70])[CH:69]=[C:60]([S:57]([CH2:56][CH2:55][CH2:54][CH2:53][CH2:52][CH2:51][CH2:50][CH2:49][CH2:48][CH2:47][CH:46]=[O:45])(=[O:58])=[O:59])[CH:61]=3)[N:66]=[CH:65][C:64]=2[C:71]([NH2:73])=[O:72])[CH:80]=[CH:79][CH:78]=1