HRID1944966

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)c5ccc(CCCCOCCCCCCBr)cc5)c4)cc23)c1

HCID66988130

未命名化合物

结构：COc1cccc(Nc2c(C(N)=O)cnc3c(C)cc(S(=O)(=O)c4cccc(C(=O)Nc5cccc(C#CCCCNC[C@H](O[Si](C)(C)C(C)(C)C)c6ccc(O)c7[nH]c(=O)ccc67)c5)c4)cc23)c1

HCID86659120

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)c5ccc(CCCCOCCCCCCNC[C@H](O[Si](C)(C)C(C)(C)C)c6ccc(O)c7[nH]c(=O)ccc67)cc5)c4)cc23)c1

HCID86659124

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 157, using Intermediate 99 in place of Intermediate 98. ES/MS calcd. for C54H73BrN6O9SSi+ 1069.5. Found m/z=1069.7 (M+H)+.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7f946c7847b84b9984fc428c8747ac34
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

[Si:1]([O:8][C@H:9]([C:58]1[CH:67]=[CH:66][C:65]([OH:68])=[C:64]2[C:59]=1[CH:60]=[CH:61][C:62](=[O:69])[NH:63]2)[CH2:10][NH:11]CCCC#CC1C=C(NC(C2C=C(S(C3C=C4C(=C(C)C=3)N=CC(C(N)=O)=C4NC3C=CC=C(OC)C=3)(=O)=O)C=CC=2)=O)C=CC=1)([C:4]([CH3:7])([CH3:6])[CH3:5])([CH3:3])[CH3:2].Br[CH2:71][CH2:72][CH2:73][CH2:74][CH2:75][CH2:76][O:77][CH2:78][CH2:79][CH2:80][CH2:81][C:82]1[CH:87]=[CH:86][C:85]([N:88]([CH3:123])[C:89]([C:91]2[CH:92]=[C:93]([S:97]([C:100]3[CH:101]=[C:102]4[C:107](=[C:108]([CH3:110])[CH:109]=3)[N:106]=[CH:105][C:104]([C:111]([NH2:113])=[O:112])=[C:103]4[NH:114][C:115]3[CH:120]=[CH:119][CH:118]=[C:117]([O:121][CH3:122])[CH:116]=3)(=[O:99])=[O:98])[CH:94]=[CH:95][CH:96]=2)=[O:90])=[CH:84][CH:83]=1>>[OH:68][C:65]1[CH:66]=[CH:67][C:58]([C@H:9]([CH2:10][NH:11][CH2:71][CH2:72][CH2:73][CH2:74][CH2:75][CH2:76][O:77][CH2:78][CH2:79][CH2:80][CH2:81][C:82]2[CH:87]=[CH:86][C:85]([N:88]([CH3:123])[C:89]([C:91]3[CH:92]=[C:93]([S:97]([C:100]4[CH:101]=[C:102]5[C:107](=[C:108]([CH3:110])[CH:109]=4)[N:106]=[CH:105][C:104]([C:111]([NH2:113])=[O:112])=[C:103]5[NH:114][C:115]4[CH:120]=[CH:119][CH:118]=[C:117]([O:121][CH3:122])[CH:116]=4)(=[O:99])=[O:98])[CH:94]=[CH:95][CH:96]=3)=[O:90])=[CH:84][CH:83]=2)[O:8][Si:1]([CH3:2])([CH3:3])[C:4]([CH3:5])([CH3:6])[CH3:7])=[C:59]2[C:64]=1[NH:63][C:62](=[O:69])[CH:61]=[CH:60]2