HRID1944951

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)c4cccc(C(=O)N(C)CCOc5ccc(CCN)cc5)c4)cc23)c1

HCID66988306

未命名化合物

结构：COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(S(=O)(=O)c4cccc(C(=O)Nc5ccc(CCNC[C@H](O[Si](C)(C)C(C)(C)C)c6ccc(OCc7ccccc7)c7[nH]c(=O)ccc67)cc5)c4)cc23)c1

HCID86659112

未命名化合物

PRODUCTS

生成物

结构：COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(S(=O)(=O)c4cccc(C(=O)N(C)CCOc5ccc(CCNC[C@H](O[Si](C)(C)C(C)(C)C)c6ccc(OCc7ccccc7)c7[nH]c(=O)ccc67)cc5)c4)cc23)c1

HCID86675627

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 140, using Intermediate 95 in place of Intermediate 94. ES/MS calcd for C60H67N6O9SSi+ 1075.45. Found m/z=1075.4 (M+H)+.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7796b73d30444250a9ad8656985ac950
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

[CH2:1]([O:8][C:9]1[CH:10]=[CH:11][C:12]([C@@H:20]([O:66][Si:67]([C:70]([CH3:73])([CH3:72])[CH3:71])([CH3:69])[CH3:68])[CH2:21]NCCC2C=CC(NC(C3C=C(S(C4C=C5C(=C(C)C=4)N=CC(C(N)=O)=C5NC4C=CC=C(OC)C=4)(=O)=O)C=CC=3)=O)=CC=2)=[C:13]2[C:18]=1[NH:17][C:16](=[O:19])[CH:15]=[CH:14]2)[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.[NH2:74][CH2:75][CH2:76][C:77]1[CH:121]=[CH:120][C:80]([O:81][CH2:82][CH2:83][N:84]([CH3:119])[C:85]([C:87]2[CH:88]=[C:89]([S:93]([C:96]3[CH:97]=[C:98]4[C:103](=[C:104]([CH3:106])[CH:105]=3)[N:102]=[CH:101][C:100]([C:107]([NH2:109])=[O:108])=[C:99]4[NH:110][C:111]3[CH:116]=[CH:115][CH:114]=[C:113]([O:117][CH3:118])[CH:112]=3)(=[O:95])=[O:94])[CH:90]=[CH:91][CH:92]=2)=[O:86])=[CH:79][CH:78]=1>>[CH2:1]([O:8][C:9]1[CH:10]=[CH:11][C:12]([C@@H:20]([O:66][Si:67]([C:70]([CH3:71])([CH3:73])[CH3:72])([CH3:69])[CH3:68])[CH2:21][NH:74][CH2:75][CH2:76][C:77]2[CH:121]=[CH:120][C:80]([O:81][CH2:82][CH2:83][N:84]([CH3:119])[C:85]([C:87]3[CH:88]=[C:89]([S:93]([C:96]4[CH:97]=[C:98]5[C:103](=[C:104]([CH3:106])[CH:105]=4)[N:102]=[CH:101][C:100]([C:107]([NH2:109])=[O:108])=[C:99]5[NH:110][C:111]4[CH:116]=[CH:115][CH:114]=[C:113]([O:117][CH3:118])[CH:112]=4)(=[O:94])=[O:95])[CH:90]=[CH:91][CH:92]=3)=[O:86])=[CH:79][CH:78]=2)=[C:13]2[C:18]=1[NH:17][C:16](=[O:19])[CH:15]=[CH:14]2)[C:2]1[CH:3]=[CH:4][CH:5]=[CH:6][CH:7]=1