HRID2151600

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID769

Bicarbonate Ion

CHO3-

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID8857

Ethyl Acetate

C4H8O2

HCID177085

(Benzyloxy)acetyl chloride

C9H9ClO2

HCID86097446

未命名化合物

PRODUCTS

产物

HCID86630838

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-b1d19bfa00f445d1bccb066499b3e9df
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

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