HRID675531

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID602

DL-Alanine

C3H7NO2

HCID962

Water

H2O

HCID8471

Triethylamine

C6H15N

HCID4075158

未命名化合物

结构：CC(C)(OS(=O)(=O)[O-])S(=O)(=O)Oc1ccc(O)cc1

HCID86745786

未命名化合物

PRODUCTS

生成物

HCID3353917

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-897a21fcffa9454c8117a865e0f8149d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[CH3:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][C:27]([O-:28])=[O:29].[CH3:7][CH2:8][N:9]([CH2:10][CH3:11])[CH2:12][CH3:13].[NH2:1][CH:2]([CH3:3])[C:4](=[O:5])[OH:6].[OH2:49].[S:30]([O-:31])([O:32][C:33]([CH3:34])([CH3:35])[S:36]([O:37][c:38]1[cH:39][cH:40][c:41]([OH:42])[cH:43][cH:44]1)(=[O:45])=[O:46])(=[O:47])=[O:48]>>[NH:1]([CH:2]([CH3:3])[C:4](=[O:5])[OH:6])[C:27]([CH2:26][CH2:25][CH2:24][CH2:23][CH2:22][CH2:21][CH2:20][CH2:19][CH2:18][CH2:17][CH2:16][CH2:15][CH3:14])=[O:28]