HRID136892

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID28123

Tetrahydroborate

H4B-

反应SMILES：CC(=O)c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)c(C(=O)Nc2ccc(Cl)cn2)c1

HCID21906196

未命名化合物

PRODUCTS

产物

HCID21906239

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-de52da334c834e2f8fa7aec588598795
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

[BH4-:36].[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([NH:20][C:21](=[O:22])[CH:23]2[CH2:24][CH2:25][N:26]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:27][CH2:28]2)[c:8]([C:9](=[O:10])[NH:11][c:12]2[n:13][cH:14][c:15]([Cl:18])[cH:16][cH:17]2)[cH:19]1.[CH3:39][OH:40].[Na+:37].[OH2:38]>>[CH:1]([CH3:2])([OH:3])[c:4]1[cH:5][cH:6][c:7]([NH:20][C:21](=[O:22])[CH:23]2[CH2:24][CH2:25][N:26]([C:29](=[O:30])[O:31][C:32]([CH3:33])([CH3:34])[CH3:35])[CH2:27][CH2:28]2)[c:8]([C:9](=[O:10])[NH:11][c:12]2[n:13][cH:14][c:15]([Cl:18])[cH:16][cH:17]2)[cH:19]1