HRID2339242

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID14668531

未命名化合物

结构：Cc1oc(Cc2ccccc2)c(C(=O)c2cc(C(C)C)c(O)c(C(C)C)c2)c1C

HCID15895033

未命名化合物

PRODUCTS

生成物

结构：Cc1oc(Cc2ccccc2)c(C(=O)c2cc(C(C)C)c(OS(=O)(=O)c3ccc(C(=O)O)c(O)c3)c(C(C)C)c2)c1C

HCID9829957

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f18b78e261514c6a8cfcc6a7362abebd
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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