HRID1540929

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

结构：COC(=O)Cc1ccccc1OCc1csc(CCc2nc(-c3ccccc3)oc2C)n1

HCID68886170

未命名化合物

PRODUCTS

生成物

结构：Cc1oc(-c2ccccc2)nc1CCc1nc(COc2ccccc2CC(=O)O)cs1

HCID68883094

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2431a1e0d30f45ca92c99d5ebb6d4534
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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