HRID122191

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID961

Hydroxide

HO-

HCID962

Water

H2O

2 次

HCID8028

Tetrahydrofuran

C4H8O

HCID28486

Lithium ion

Li+

结构：CCC(CC)CNC(=O)c1ccc2cccc(Cc3ccc(C(=O)OC)cc3OC)c2c1

HCID19906363

未命名化合物

PRODUCTS

生成物

结构：CCC(CC)CNC(=O)c1ccc2cccc(Cc3ccc(C(=O)O)cc3OC)c2c1

HCID19906369

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9aa428d40ec74fc4a1b0378b40bae649
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

[CH2:4]([CH3:5])[CH:6]([CH2:7][NH:8][C:9](=[O:10])[c:11]1[cH:12][cH:13][c:14]2[cH:15][cH:16][cH:17][c:18]([CH2:21][c:22]3[c:23]([O:32][CH3:33])[cH:24][c:25]([C:26](=[O:27])[O:28][CH3:29])[cH:30][cH:31]3)[c:19]2[cH:20]1)[CH2:34][CH3:35].[CH3:36][OH:37].[Li+:3].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1.[OH-:2].[OH2:1].[OH2:43]>>[CH2:4]([CH3:5])[CH:6]([CH2:7][NH:8][C:9](=[O:10])[c:11]1[cH:12][cH:13][c:14]2[cH:15][cH:16][cH:17][c:18]([CH2:21][c:22]3[c:23]([O:32][CH3:33])[cH:24][c:25]([C:26](=[O:27])[OH:28])[cH:30][cH:31]3)[c:19]2[cH:20]1)[CH2:34][CH3:35]