HRID2326451

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID1140

Toluene

C7H8

HCID8028

Tetrahydrofuran

C4H8O

HCID24386

Thionyl chloride

Cl2OS

HCID90831

3-(tert-Butylamino)propane-1,2-diol

C7H17NO2

结构：O=C(O)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1

HCID10854155

3,4-Bis(benzyloxy)benzoic acid

C21H18O4

PRODUCTS

生成物

结构：CC(C)(C)NCC(O)COC(=O)c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1

HCID20406945

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e1966c2b6b274f0c981b471cc78eecdd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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