HRID174658

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID787

Hydroxylamine

H3NO

结构：CN(CCC(=O)OC1CCC2(C)C(C1)C(=O)CC1C3CCC(=O)C3(C)CCC12)C(=O)OCc1ccccc1

HCID178483964

未命名化合物

PRODUCTS

生成物

结构：CN(CCC(=O)OC1CCC2(C)C(C1)C(=NO)CC1C3CCC(=O)C3(C)CCC12)C(=O)OCc1ccccc1

HCID178483963

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-19b9da94232c49989f4ba848a3c77b50
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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