HRID156819

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID784

Hydrogen peroxide

H2O2

HCID8028

Tetrahydrofuran

C4H8O

HCID13831

Tributylphosphine

C12H27P

HCID103931

Selenocyanic acid, 2-nitrophenyl ester

C7H4N2O2Se

结构：CCCCCC(C=CC(CCO)C(CC(OC)OC)OCc1ccccc1)OCc1ccccc1

HCID54158915

未命名化合物

PRODUCTS

生成物

结构：C=CC(C=CC(CCCCC)OCc1ccccc1)C(CC(OC)OC)OCc1ccccc1

HCID53965799

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1c86ae5624074e22a4e38e3077060bed
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

[CH2:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[O:20][CH:21]([CH2:22][CH:23]([O:24][CH3:25])[O:26][CH3:27])[CH:28]([CH:29]=[CH:30][CH:31]([CH2:32][CH2:33][CH2:34][CH2:35][CH3:36])[O:37][CH2:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[CH2:45][CH2:46][OH:47].[CH2:48]([P:49]([CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH2:56][CH3:57])[CH2:58][CH2:59][CH3:60].[N+:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][c:7]1[Se:8][C:9]#[N:10])([O-:11])=[O:12].[O:63]1[CH2:64][CH2:65][CH2:66][CH2:67]1.[OH:61][OH:62]>>[CH2:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)[O:20][CH:21]([CH2:22][CH:23]([O:24][CH3:25])[O:26][CH3:27])[CH:28]([CH:29]=[CH:30][CH:31]([CH2:32][CH2:33][CH2:34][CH2:35][CH3:36])[O:37][CH2:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[CH:45]=[CH2:46]