HRID958244

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID760

Glyoxylic acid

C2H2O3

HCID962

Water

H2O

结构：Cc1cc(B(O)O)ccc1CCOC(=O)Nc1cccc(C#N)c1

HCID57842579

未命名化合物

结构：CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1nccc2cc(N)ccc12

HCID58717298

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C(Nc2ccc3c(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)nccc3c2)C(=O)O)ccc1CCOC(=O)Nc1cccc(C#N)c1

HCID57956367

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9a7b0fc5763c4b8693f41e98f480d58d
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:1](#[N:2])[c:3]1[cH:4][c:5]([NH:9][C:10](=[O:11])[O:12][CH2:13][CH2:14][c:15]2[c:16]([CH3:24])[cH:17][c:18]([B:21]([OH:22])[OH:23])[cH:19][cH:20]2)[cH:6][cH:7][cH:8]1.[C:52]([CH:53]=[O:54])(=[O:55])[OH:56].[NH2:25][c:26]1[cH:27][c:28]2[cH:29][cH:30][n:31][c:32]([N:36]([C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[C:44](=[O:45])[O:46][C:47]([CH3:48])([CH3:49])[CH3:50])[c:33]2[cH:34][cH:35]1.[OH2:51]>>[C:1](#[N:2])[c:3]1[cH:4][c:5]([NH:9][C:10](=[O:11])[O:12][CH2:13][CH2:14][c:15]2[c:16]([CH3:24])[cH:17][c:18]([CH:53]([NH:25][c:26]3[cH:27][c:28]4[cH:29][cH:30][n:31][c:32]([N:36]([C:37](=[O:38])[O:39][C:40]([CH3:41])([CH3:42])[CH3:43])[C:44](=[O:45])[O:46][C:47]([CH3:48])([CH3:49])[CH3:50])[c:33]4[cH:34][cH:35]3)[C:52](=[O:55])[OH:56])[cH:19][cH:20]2)[cH:6][cH:7][cH:8]1