HRID947008

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID7096

Phenylpiperazine

C10H14N2

HCID2724942

未命名化合物

结构：CC(CC=O)C1CC=C2C3=C(CCC21C)C1(C)CCC(O)C(C)(C)C1CC3

HCID22381677

未命名化合物

PRODUCTS

生成物

结构：CC(CCN1CCN(c2ccccc2)CC1)C1CC=C2C3=C(CCC21C)C1(C)CCC(O)C(C)(C)C1CC3

HCID20812443

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f2a07da8425a4fc886af252428291642
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[C:40]([O:41][BH-:42]([O:43][C:44](=[O:45])[CH3:46])[O:47][C:48](=[O:49])[CH3:50])(=[O:51])[CH3:52].[Na+:53].[OH:1][CH:2]1[C:3]([CH3:26])([CH3:27])[CH:4]2[CH2:5][CH2:6][C:7]3=[C:20]([CH2:19][CH2:18][C:17]4([CH3:25])[C:8]3=[CH:9][CH2:10][CH:11]4[CH:12]([CH2:13][CH:14]=[O:15])[CH3:16])[C:21]2([CH3:24])[CH2:22][CH2:23]1.[c:28]1([N:34]2[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]2)[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[OH:1][CH:2]1[C:3]([CH3:26])([CH3:27])[CH:4]2[CH2:5][CH2:6][C:7]3=[C:20]([CH2:19][CH2:18][C:17]4([CH3:25])[C:8]3=[CH:9][CH2:10][CH:11]4[CH:12]([CH2:13][CH2:14][N:37]3[CH2:36][CH2:35][N:34]([c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[CH2:39][CH2:38]3)[CH3:16])[C:21]2([CH3:24])[CH2:22][CH2:23]1