HRID191867

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3401206

3,3-dimethyl-2-(phenylmethoxycarbonylamino)butanoic acid

C14H19NO4

结构：CC(C)(C)NC(=O)C1CCCCC1CC(O)C(N)Cc1ccccc1

HCID70035284

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)NC(=O)C1CCCCC1CC(O)C(Cc1ccccc1)NC(=O)C(NC(=O)OCc1ccccc1)C(C)(C)C

HCID178449289

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-36f088b30e354546a9cb61462d976059
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

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]([C:13]([CH3:14])([CH3:15])[CH3:16])[C:17](=[O:18])[OH:19].[NH2:20][CH:21]([CH:22]([CH2:23][CH:24]1[CH:25]([C:30](=[O:31])[NH:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:26][CH2:27][CH2:28][CH2:29]1)[OH:37])[CH2:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]([C:13]([CH3:14])([CH3:15])[CH3:16])[C:17](=[O:19])[NH:20][CH:21]([CH:22]([CH2:23][CH:24]1[CH:25]([C:30](=[O:31])[NH:32][C:33]([CH3:34])([CH3:35])[CH3:36])[CH2:26][CH2:27][CH2:28][CH2:29]1)[OH:37])[CH2:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1