HRID1205286

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID4113

Methoxyamine

CH5NO

HCID76257

Diethylphosphorocyanidate

C5H10NO3P

结构：Cc1ccc2[nH]cc(Cn3nc4c(c3-c3cc(C(=O)O)cn3C)c(=O)n(C)c(=O)n4CC3CC3)c2c1

HCID58980980

未命名化合物

PRODUCTS

生成物

结构：CONC(=O)c1cc(-c2c3c(=O)n(C)c(=O)n(CC4CC4)c3nn2Cc2c[nH]c3ccc(C)cc23)n(C)c1

HCID44241625

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-e1226c617591458c9e9f48f6cfc6e2ff
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[C:41]([P:42](=[O:43])([O:44][CH2:45][CH3:46])[O:47][CH2:48][CH3:49])#[N:50].[CH:1]1([CH2:4][n:5]2[c:6](=[O:36])[n:7]([CH3:35])[c:8](=[O:34])[c:9]3[c:10]2[n:11][n:12]([CH2:23][c:24]2[cH:25][nH:26][c:27]4[cH:28][cH:29][c:30]([CH3:33])[cH:31][c:32]24)[c:13]3-[c:14]2[cH:15][c:16]([C:20](=[O:21])[OH:22])[cH:17][n:18]2[CH3:19])[CH2:2][CH2:3]1.[ClH:37].[O:38]([CH3:39])[NH2:40]>>[CH:1]1([CH2:4][n:5]2[c:6](=[O:36])[n:7]([CH3:35])[c:8](=[O:34])[c:9]3[c:10]2[n:11][n:12]([CH2:23][c:24]2[cH:25][nH:26][c:27]4[cH:28][cH:29][c:30]([CH3:33])[cH:31][c:32]24)[c:13]3-[c:14]2[cH:15][c:16]([C:20](=[O:22])[NH:40][O:38][CH3:39])[cH:17][n:18]2[CH3:19])[CH2:2][CH2:3]1