HRID285152

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID876

(+-)-Methionine

C5H11NO2S

HCID962

Water

H2O

HCID6395

Methanesulfonic acid

CH4O3S

结构：COc1cccc2c1CCC(COC(=O)N(c1ccccc1)c1ccccc1)C2

HCID54050642

未命名化合物

PRODUCTS

生成物

结构：O=C(OCC1CCc2c(O)cccc2C1)N(c1ccccc1)c1ccccc1

HCID54103601

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-04579c9f12e748189dc067bf3a3b6716
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

[CH3:40][S:41](=[O:42])(=[O:43])[OH:44].[NH2:30][CH:31]([C:32]([OH:33])=[O:34])[CH2:35][CH2:36][S:37][CH3:38].[OH2:39].[c:1]1([N:7]([C:8]([O:9][CH2:10][CH:11]2[CH2:12][c:13]3[cH:14][cH:15][cH:16][c:17]([O:21][CH3:22])[c:18]3[CH2:19][CH2:20]2)=[O:23])[c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([N:7]([C:8]([O:9][CH2:10][CH:11]2[CH2:12][c:13]3[cH:14][cH:15][cH:16][c:17]([OH:21])[c:18]3[CH2:19][CH2:20]2)=[O:23])[c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1