HRID301534

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID7900

1-Methoxy-2-propanol

C4H10O2

HCID3280088

未命名化合物

结构：CCCCOc1ncc(C(C)=O)cc1-c1nc2c(CC)n(CCOC)nc2c(=O)[nH]1

HCID135484634

未命名化合物

PRODUCTS

生成物

结构：CCc1c2nc(-c3cc(C(C)=O)cnc3OC(C)COC)[nH]c(=O)c2nn1CCOC

HCID135455945

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-84e012236321406ab6753c2f2e2a42d9
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

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