HRID105460

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID222

Ammonia gas

H3N

HCID962

Water

H2O

HCID1049

Pyridine

C5H5N

HCID6397

Chlorotrimethylsilane

C3H9ClSi

HCID68515

Benzoyl chloride, 4-bromo-

C7H4BrClO

结构：CC1(C)OC2C(CO)OC(n3cnc4c(N)ncnc43)C2O1

HCID232179

9-[2,3-O-(1-Methylethylidene)pentofuranosyl]-9H-purin-6-amine

C13H17N5O4

PRODUCTS

生成物

结构：CC1(C)OC2C(CO)OC(n3cnc4c(NC(=O)c5ccc(Br)cc5)ncnc43)C2O1

HCID178431258

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b76fd825b4184ab990395050a7dac94e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[Br:28][c:29]1[cH:30][cH:31][c:32]([C:33](=[O:34])[Cl:35])[cH:36][cH:37]1.[CH3:23][Si:24]([Cl:25])([CH3:26])[CH3:27].[NH2:1][c:2]1[c:3]2[n:4][cH:5][n:6]([CH:11]3[O:12][CH:13]([CH2:21][OH:22])[CH:14]4[CH:15]3[O:16][C:17]([CH3:19])([CH3:20])[O:18]4)[c:7]2[n:8][cH:9][n:10]1.[NH3:38].[OH2:45].[cH:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1>>[NH:1]([c:2]1[c:3]2[n:4][cH:5][n:6]([CH:11]3[O:12][CH:13]([CH2:21][OH:22])[CH:14]4[CH:15]3[O:16][C:17]([CH3:19])([CH3:20])[O:18]4)[c:7]2[n:8][cH:9][n:10]1)[C:33]([c:32]1[cH:31][cH:30][c:29]([Br:28])[cH:37][cH:36]1)=[O:34]