HRID2160113

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID5126

2-Amino-1-propanol

C3H9NO

HCID2734060

未命名化合物

结构：COCC(C)Oc1cc(O[Si](C(C)C)(C(C)C)C(C)C)cc(-c2ccc(C(=O)O)[nH]2)c1

HCID178495538

未命名化合物

PRODUCTS

生成物

结构：COCC(C)Oc1cc(O[Si](C(C)C)(C(C)C)C(C)C)cc(-c2ccc(C(=O)NC(C)CO)[nH]2)c1

HCID178495531

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d475327fc0c34fedb24d22efd43c820a
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

[CH3:1][O:2][CH2:3][CH:4]([O:5][c:6]1[cH:7][c:8](-[c:23]2[cH:24][cH:25][c:26]([C:28](=[O:29])[OH:30])[nH:27]2)[cH:9][c:10]([O:12][Si:13]([CH:14]([CH3:15])[CH3:16])([CH:17]([CH3:18])[CH3:19])[CH:20]([CH3:21])[CH3:22])[cH:11]1)[CH3:31].[CH3:38][O:39][c:40]1[n:41][c:42]([O:43][CH3:44])[n:45][c:46]([N+:47]2([CH3:48])[CH2:49][CH2:50][O:51][CH2:52][CH2:53]2)[n:54]1.[CH3:56][OH:57].[Cl-:37].[NH2:32][CH:33]([CH3:34])[CH2:35][OH:36].[OH2:55]>>[CH3:1][O:2][CH2:3][CH:4]([O:5][c:6]1[cH:7][c:8](-[c:23]2[cH:24][cH:25][c:26]([C:28](=[O:29])[NH:32][CH:33]([CH3:34])[CH2:35][OH:36])[nH:27]2)[cH:9][c:10]([O:12][Si:13]([CH:14]([CH3:15])[CH3:16])([CH:17]([CH3:18])[CH3:19])[CH:20]([CH3:21])[CH3:22])[cH:11]1)[CH3:31]