HRID282530

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6395

Methanesulfonic acid

CH4O3S

HCID7360

Tetrahydrofurfuryl alcohol

C5H10O2

HCID166653

Hydride

H-

结构：CC1(C)C(C(=O)c2c[nH]c3ccc(OCc4ccccc4)cc23)C1(C)C

HCID24824475

未命名化合物

PRODUCTS

生成物

结构：CC1(C)C(C(=O)c2cn(CC3CCCO3)c3ccc(OCc4ccccc4)cc23)C1(C)C

HCID178426794

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1e8c623959874d4c8d1a9270ff244125
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

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