HRID107232

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID612

Lactic acid

C3H6O3

HCID962

Water

H2O

HCID24247

Perchloric acid

HClO4

结构：CN1CCN(c2ccc3[nH]c(-c4c(N)c5c(F)cccc5[nH]c4=O)nc3c2)CC1

HCID178480639

未命名化合物

PRODUCTS

生成物

HCID612

Lactic acid

C3H6O3

HCID178480639

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ee32895d363d492683c53987e0f2825e
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

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