HRID297219

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID176

Acetic Acid

C2H4O2

HCID962

Water

H2O

结构：CCCc1nc(C(C)(C)O)c(C(=O)OCc2oc(=O)oc2C)n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID19036162

Tritylolmesartan medoxomil

C48H44N6O6

PRODUCTS

生成物

结构：CCCc1nc(C(C)(C)O)c(C(=O)OCc2oc(=O)oc2C)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

HCID178440075

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8fcf38a3a93e4c1292239d8b5550fa08
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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