HRID181709

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID433623

未命名化合物

结构：CC(O)C(O)C1CNc2[nH]c(N=CN(C)C)nc(=O)c2N1C(=O)OC(C)(C)C

HCID178469704

未命名化合物

PRODUCTS

生成物

结构：CCC(C)C(NC(=O)OC(C)(C)C)C(=O)OC(C)C(O)C1CNc2[nH]c(N=CN(C)C)nc(=O)c2N1C(=O)OC(C)(C)C

HCID178446792

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e59798e7a88443669e4ace3e2635890e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[c:9]2[c:10](=[O:28])[n:11][c:12]([N:23]=[CH:24][N:25]([CH3:26])[CH3:27])[nH:13][c:14]2[NH:15][CH2:16][CH:17]1[CH:18]([CH:19]([CH3:20])[OH:21])[OH:22].[C:29](=[O:30])([O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[NH:36][CH:37]([CH:38]([CH3:39])[CH2:40][CH3:41])[C:42](=[O:43])[OH:44]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[c:9]2[c:10](=[O:28])[n:11][c:12]([N:23]=[CH:24][N:25]([CH3:26])[CH3:27])[nH:13][c:14]2[NH:15][CH2:16][CH:17]1[CH:18]([CH:19]([CH3:20])[O:21][C:42]([CH:37]([NH:36][C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH:38]([CH3:39])[CH2:40][CH3:41])=[O:43])[OH:22]