HRID188280

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID887

Methanol

CH4O

HCID962

Water

H2O

HCID73561

1,2-Propanediol, 3-amino-

C3H9NO2

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)NCC(O)CO)[nH]2)c1

HCID178495534

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-372fe016a79e45be84f77821bed6cd9f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

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].[CH3:39][O:40][c:41]1[n:42][c:43]([O:44][CH3:45])[n:46][c:47]([N+:48]2([CH3:49])[CH2:50][CH2:51][O:52][CH2:53][CH2:54]2)[n:55]1.[CH3:57][OH:58].[Cl-:38].[NH2:32][CH2:33][CH:34]([CH2:35][OH:36])[OH:37].[OH2:56]>>[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][CH2:33][CH:34]([CH2:35][OH:36])[OH:37])[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]