HRID103320

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6395

Methanesulfonic acid

CH4O3S

HCID8028

Tetrahydrofuran

C4H8O

结构：CCOc1cc2c(cc1OC)C(c1ccc(OC)nc1OC)=NC1CCC(O)CC21

HCID11567783

未命名化合物

PRODUCTS

生成物

HCID6395

Methanesulfonic acid

CH4O3S

HCID11567783

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-970794a3fa5749229afc781e5c33c1d5
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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