HRID2133330

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID11776

Triphenylphosphine

C18H15P

HCID75222

Benzaldehyde, 4-hydroxy-3,5-dimethyl-

C9H10O2

HCID75555

未命名化合物

HCID10856726

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C=O)cc(C)c1OCCc1nc(C2CCCCC2)oc1C

HCID21949659

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d55a3e297d954f2cb00c41d4a64251cf
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

[CH3:16][c:17]1[cH:18][c:19]([CH:20]=[O:21])[cH:22][c:23]([CH3:26])[c:24]1[OH:25].[CH3:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1.[CH:1]1([c:7]2[o:8][c:9]([CH3:15])[c:10]([CH2:12][CH2:13][OH:14])[n:11]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[O:46]=[C:47]([O:48][CH:49]([CH3:50])[CH3:51])[N:52]=[N:53][C:54]([O:55][CH:56]([CH3:57])[CH3:58])=[O:59].[c:27]1([P:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH:1]1([c:7]2[o:8][c:9]([CH3:15])[c:10]([CH2:12][CH2:13][O:14][c:24]3[c:17]([CH3:16])[cH:18][c:19]([CH:20]=[O:21])[cH:22][c:23]3[CH3:26])[n:11]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1