HRID157532

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6569

Methyl ethyl ketone

C4H8O

HCID19660

Carbonate

CO3-2

HCID2776064

Benzyl 3-bromopropyl ether

C10H13BrO

结构：CC(C)(C)OC(=O)N1CC(O)C(c2ccc(O)cc2)C(CO)C1

HCID15546931

tert-butyl (3RS,4RS,5SR)-3-hydroxy-5-hydroxymethyl-4-(4-hydroxy-phenyl)-piperidine-1-carboxylate

C17H25NO5

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CC(O)C(c2ccc(OCCCOCc3ccccc3)cc2)C(CO)C1

HCID86604522

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-ca41514f708f4c039cb0ac5f33e482ac
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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