HRID1145458

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID712

Formaldehyde

CH2O

HCID791

2-Amino-3-methyl-pentanoic acid

C6H13NO2

HCID813

Potassium cation

K+

3 次

HCID1050

Pyridoxal

C8H9NO3

HCID1061

Phosphate

O4P-3

2 次

结构：CC1(C)SC2C(NC(=O)C(N)c3ccccc3)C(=O)N2C1C(=O)O

HCID2174

6-[(2-Amino-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

C16H19N3O4S

PRODUCTS

生成物

HCID87481216

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9cbf8177367a468a85e46ca4d534225c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

[CH2:25]=[O:26].[CH3:27][CH2:28][CH:29]([CH3:30])[CH:31]([NH2:32])[C:33]([OH:34])=[O:35].[CH:1]12[CH:2]([NH:3][C:4]([CH:5]([c:6]3[cH:7][cH:10][cH:11][cH:12][cH:13]3)[NH2:14])=[O:15])[C:8](=[O:9])[N:16]1[CH:17]([C:18](=[O:19])[OH:20])[C:21]([CH3:22])([CH3:23])[S:24]2.[CH:36]([c:37]1[c:38]([OH:39])[c:40]([CH3:41])[n:42][cH:43][c:44]1[CH2:45][OH:46])=[O:47].[K+:58].[K+:59].[K+:60].[O-:48][P:49](=[O:50])([O-:51])[O-:52].[P:53]([O-:54])([O-:55])([O-:56])=[O:57]>>[CH2:8]([OH:9])[C:31]([CH:29]([CH2:28][CH3:27])[CH3:30])([NH2:32])[C:33]([OH:34])=[O:35]