HRID310923

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID769

Bicarbonate Ion

CHO3-

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

结构：CC(CO[Si](C)(C)C(C)(C)C)Oc1cc(Oc2ccc(C(=O)N3CCC3)cc2)cc(C(=O)Nc2nccs2)c1

HCID178460640

未命名化合物

PRODUCTS

生成物

结构：CC(CO)Oc1cc(Oc2ccc(C(=O)N3CCC3)cc2)cc(C(=O)Nc2nccs2)c1

HCID178460379

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d3c0b30068fa40f89116b2321e879a25
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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