HRID145362

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID2724942

未命名化合物

HCID4187788

(tert-Butyldimethylsilyloxy)acetaldehyde

C8H18O2Si

结构：COC(=O)c1ccc(-c2ccccc2)cc1NC(=O)c1cc(C2CCNCC2)ccc1OCc1ccccc1

HCID66990546

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(-c2ccccc2)cc1NC(=O)c1cc(C2CCN(CCO[Si](C)(C)C(C)(C)C)CC2)ccc1OCc1ccccc1

HCID66990280

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1514e8bde68a4766b93dbd22a92c9883
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[C:16]([O:17][BH-:18]([O:19][C:20](=[O:21])[CH3:22])[O:23][C:24](=[O:25])[CH3:26])(=[O:27])[CH3:28].[C:5]([CH3:6])([CH3:7])([CH3:8])[Si:9]([O:10][CH2:11][CH:12]=[O:13])([CH3:14])[CH3:15].[CH2:30]([c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1)[O:37][c:38]1[c:39]([C:40](=[O:41])[NH:42][c:43]2[c:44]([C:45](=[O:46])[O:47][CH3:48])[cH:49][cH:50][c:51](-[c:53]3[cH:54][cH:55][cH:56][cH:57][cH:58]3)[cH:52]2)[cH:59][c:60]([CH:63]2[CH2:64][CH2:65][NH:66][CH2:67][CH2:68]2)[cH:61][cH:62]1.[CH3:1][C:2](=[O:3])[OH:4].[Na+:29].[O:69]1[CH2:70][CH2:71][CH2:72][CH2:73]1>>[C:5]([CH3:6])([CH3:7])([CH3:8])[Si:9]([O:10][CH2:11][CH2:12][N:66]1[CH2:65][CH2:64][CH:63]([c:60]2[cH:59][c:39]([C:40](=[O:41])[NH:42][c:43]3[c:44]([C:45](=[O:46])[O:47][CH3:48])[cH:49][cH:50][c:51](-[c:53]4[cH:54][cH:55][cH:56][cH:57][cH:58]4)[cH:52]3)[c:38]([O:37][CH2:30][c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)[cH:62][cH:61]2)[CH2:68][CH2:67]1)([CH3:14])[CH3:15]