HRID181839

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID311

Citric Acid

C6H8O7

HCID923

Sodium ion

Na+

HCID8028

Tetrahydrofuran

C4H8O

HCID166653

Hydride

H-

HCID11265570

4-CHLORO-1-(2-CHLOROPHENYL)-1H-PYRAZOLO[3,4-D]PYRIMIDINE

C11H6Cl2N4

HCID66813497

未命名化合物

PRODUCTS

产物

HCID76550500

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-48d97b605c324f92b6a1826cc19a5815
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应SMILES

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