HRID1540190

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID89553

(3-Phenyl-2-oxiranyl)methanol

C9H10O2

HCID114942

Titanium(4+)

Ti+4

HCID166653

Hydride

H-

HCID3260420

未命名化合物

4 次

HCID13306292

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)n1c(=O)n(C(c2ccccc2)C(O)CO)c2ccccc21

HCID178448708

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1bef52ecefb1456fafbdfac042e25316
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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