HRID80591

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC[C@@H](NC(=O)N1Cc2nnc(C)n2C[C@H](Cc2cc(Cl)ccc2OC)C1=O)c1ccc(C(=O)OC(C)(C)C)c(N)c1

HCID86672194

未命名化合物

结构：CC[C@@H](NC(=O)N1Cc2nnc(O)n2C[C@H](Cc2cc(Cl)ccc2OC)C1=O)c1cccc(C(=O)OC(C)(C)C)c1

HCID178456082

未命名化合物

PRODUCTS

生成物

结构：CC[C@@H](NC(=O)N1Cc2nnc(O)n2C[C@H](Cc2cc(Cl)ccc2OC)C1=O)c1cccc(C(=O)O)c1

HCID178456081

未命名化合物

PROCEDURE

实验过程

Instead of the starting material of Example 87, Step (3), that is, the compound 87b, the compound 92a was used for a similar procedure as in Example 87, Step (3) to obtain the title compound.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-5b18954b1f1a4006ba7ec9dd50f5cc63
来源数据集: uspto-grants-2014_09
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08846660B2
来源说明: uspto-grants-2014_09

反应 SMILES

NC1C=C([C@H](NC(N2C(=O)[C@@H](CC3C=C(Cl)C=CC=3OC)CN3C(C)=NN=C3C2)=O)CC)C=CC=1C(OC(C)(C)C)=O.[Cl:43][C:44]1[CH:45]=[CH:46][C:47]([O:82][CH3:83])=[C:48]([CH:81]=1)[CH2:49][C@H:50]1[CH2:56][N:55]2[C:57]([OH:60])=[N:58][N:59]=[C:54]2[CH2:53][N:52]([C:61]([NH:63][C@@H:64]([C:67]2[CH:68]=[C:69]([CH:77]=[CH:78][CH:79]=2)[C:70]([O:72]C(C)(C)C)=[O:71])[CH2:65][CH3:66])=[O:62])[C:51]1=[O:80]>>[Cl:43][C:44]1[CH:45]=[CH:46][C:47]([O:82][CH3:83])=[C:48]([CH:81]=1)[CH2:49][C@H:50]1[CH2:56][N:55]2[C:57]([OH:60])=[N:58][N:59]=[C:54]2[CH2:53][N:52]([C:61]([NH:63][C@@H:64]([C:67]2[CH:68]=[C:69]([CH:77]=[CH:78][CH:79]=2)[C:70]([OH:72])=[O:71])[CH2:65][CH3:66])=[O:62])[C:51]1=[O:80]