HRID149438

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID13145036

2-Amino-4-phenylbutan-1-ol

C10H15NO

结构：CC(C)(C)OC(=O)N1CCC(=O)N(OCc2ccccc2)CC1CCc1ccccc1

HCID67080843

未命名化合物

结构：CC(C)(C)OC(=O)N(CCC(=O)NOCc1ccccc1)C(CO)CCc1ccccc1

HCID91563241

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(=O)NCC1CCc1ccccc1

HCID67081012

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-804f31760371487fbd07a53aacb218ec
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:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18]([N:19]([CH:20]([CH2:21][OH:42])[CH2:23][CH2:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[CH2:31][CH2:32][C:33]([NH:34][O:22][CH2:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1)=[O:43])=[O:44].[C:45]([O:46][C:47]([N:48]1[CH2:49][CH2:50][C:51](=[O:52])[N:53]([O:54][CH2:55][c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[CH2:62][CH:63]1[CH2:64][CH2:65][c:66]1[cH:67][cH:68][cH:69][cH:70][cH:71]1)=[O:72])([CH3:73])([CH3:74])[CH3:75].[NH2:1][CH:2]([CH2:3][CH2:4][c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[CH2:11][OH:12]>>[C:13]([CH3:14])([CH3:15])([CH3:16])[O:17][C:18]([N:19]1[CH:20]([CH2:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[CH2:21][NH:34][C:33](=[O:43])[CH2:32][CH2:31]1)=[O:44]