HRID319325

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

HCID923

Sodium ion

Na+

HCID961

Hydroxide

HO-

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

反应SMILES：COC(=O)Cc1ccccc1OCc1ccccc1OCc1nc(-c2ccccc2)oc1C

HCID68886082

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1oc(-c2ccccc2)nc1COc1ccccc1COc1ccccc1CC(=O)O

HCID69351521

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-d29d7828d94b4adb92e9c18d731ebef5
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

[CH3:1][c:2]1[c:3]([CH2:13][O:14][c:15]2[c:16]([CH2:17][O:18][c:19]3[c:20]([CH2:25][C:26](=[O:27])[O:28][CH3:29])[cH:21][cH:22][cH:23][cH:24]3)[cH:30][cH:31][cH:32][cH:33]2)[n:4][c:5](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[o:6]1.[CH3:43][OH:44].[ClH:41].[Na+:40].[O:34]1[CH2:35][CH2:36][CH2:37][CH2:38]1.[OH-:39].[OH2:42]>>[CH3:1][c:2]1[c:3]([CH2:13][O:14][c:15]2[c:16]([CH2:17][O:18][c:19]3[c:20]([CH2:25][C:26](=[O:27])[OH:28])[cH:21][cH:22][cH:23][cH:24]3)[cH:30][cH:31][cH:32][cH:33]2)[n:4][c:5](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[o:6]1