HRID109905

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8058

n-Hexane

C6H14

HCID8857

Ethyl acetate

C4H8O2

HCID76652

Phenylalaninol

C9H13NO

HCID13026913

Methyl 5-(benzyloxy)-2-hydroxybenzoate

C15H14O4

PRODUCTS

生成物

结构：O=C(NC(CO)Cc1ccccc1)c1cc(OCc2ccccc2)ccc1O

HCID73407719

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0716423df75c4c7092ec4f5d625131c7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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