HRID820694

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID962

Water

H2O

HCID6457

Benzenemethanol, .alpha.,.alpha.-diphenyl-

C19H16O

结构：COC(=O)c1c(C(C)(C)O)nc(C(C)OC)n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID19036227

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1c(C(C)(C)O)nc(C(C)OC)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

HCID178497993

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1b99b8ecb177453094c9f92c8449ce84
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:59]([OH:60])([c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1)([c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1)[c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1.[CH3:55][C:56](=[O:57])[OH:58].[OH2:79].[OH:1][C:2]([CH3:3])([CH3:4])[c:5]1[n:6][c:7]([CH:51]([CH3:52])[O:53][CH3:54])[n:8]([CH2:14][c:15]2[cH:16][cH:17][c:18](-[c:21]3[c:22](-[c:27]4[n:28][n:29][n:30][n:31]4[C:32]([c:33]4[cH:34][cH:35][cH:36][cH:37][cH:38]4)([c:39]4[cH:40][cH:41][cH:42][cH:43][cH:44]4)[c:45]4[cH:46][cH:47][cH:48][cH:49][cH:50]4)[cH:23][cH:24][cH:25][cH:26]3)[cH:19][cH:20]2)[c:9]1[C:10](=[O:11])[O:12][CH3:13]>>[OH:1][C:2]([CH3:3])([CH3:4])[c:5]1[n:6][c:7]([CH:51]([CH3:52])[O:53][CH3:54])[n:8]([CH2:14][c:15]2[cH:16][cH:17][c:18](-[c:21]3[c:22](-[c:27]4[n:28][n:29][n:30][nH:31]4)[cH:23][cH:24][cH:25][cH:26]3)[cH:19][cH:20]2)[c:9]1[C:10](=[O:11])[O:12][CH3:13]