HRID104513

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID923

Sodium ion

Na+

3 次

HCID8028

Tetrahydrofuran

C4H8O

HCID19660

Carbonate

CO3-2

HCID2724942

未命名化合物

结构：CC(C)C(O)C(NC(=O)OCc1ccccc1)C(=O)NCCC=O

HCID20759880

未命名化合物

结构：COc1ccc(Cn2c(=O)ccn(C3OC(C(O)C(N)C(=O)OC(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C3O[Si](C)(C)C(C)(C)C)c2=O)cc1

HCID178490862

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(Cn2c(=O)ccn(C3OC(C(O)C(NCCCNC(=O)C(NC(=O)OCc4ccccc4)C(O)C(C)C)C(=O)OC(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C3O[Si](C)(C)C(C)(C)C)c2=O)cc1

HCID20759923

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-55d7f8f1cfe143edaf09c359d327dd65
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[C:74]([O:75][BH-:76]([O:77][C:78](=[O:79])[CH3:80])[O:81][C:82](=[O:83])[CH3:84])(=[O:85])[CH3:86].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH:11]([CH:12]([CH:13]([CH3:14])[CH3:15])[OH:16])[C:17]([NH:18][CH2:19][CH2:20][CH:21]=[O:22])=[O:23])=[O:24].[CH3:99][C:100](=[O:101])[OH:102].[NH2:25][CH:26]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH:34]([OH:35])[CH:36]1[O:37][CH:38]([n:57]2[c:58](=[O:73])[n:59]([CH2:64][c:65]3[cH:66][cH:67][c:68]([O:71][CH3:72])[cH:69][cH:70]3)[c:60](=[O:63])[cH:61][cH:62]2)[CH:39]([O:49][Si:50]([CH3:51])([CH3:52])[C:53]([CH3:54])([CH3:55])[CH3:56])[CH:40]1[O:41][Si:42]([CH3:43])([CH3:44])[C:45]([CH3:46])([CH3:47])[CH3:48].[Na+:87].[Na+:88].[Na+:89].[O-:90][C:91](=[O:92])[O-:93].[O:94]1[CH2:95][CH2:96][CH2:97][CH2:98]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([NH:10][CH:11]([CH:12]([CH:13]([CH3:14])[CH3:15])[OH:16])[C:17]([NH:18][CH2:19][CH2:20][CH2:21][NH:25][CH:26]([C:27](=[O:28])[O:29][C:30]([CH3:31])([CH3:32])[CH3:33])[CH:34]([OH:35])[CH:36]1[O:37][CH:38]([n:57]2[c:58](=[O:73])[n:59]([CH2:64][c:65]3[cH:66][cH:67][c:68]([O:71][CH3:72])[cH:69][cH:70]3)[c:60](=[O:63])[cH:61][cH:62]2)[CH:39]([O:49][Si:50]([CH3:51])([CH3:52])[C:53]([CH3:54])([CH3:55])[CH3:56])[CH:40]1[O:41][Si:42]([CH3:43])([CH3:44])[C:45]([CH3:46])([CH3:47])[CH3:48])=[O:23])=[O:24]