HRID2141458

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

2 次

HCID923

Sodium ion

Na+

HCID1001

Phenethylamine

C8H11N

HCID2724942

未命名化合物

HCID17838194

未命名化合物

PRODUCTS

产物

反应SMILES：c1ccc(CCNC2CCC(Nc3cccc4cnccc34)CC2)cc1

HCID44422393

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-4db5da17492a4a3a923d4ee504bbe923
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

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