HRID1211612

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID86079

Tetrahydro-2-furancarboxylic acid

C5H8O3

HCID4641409

(Dimethylamino)-N,N-dimethyl(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yloxy)methaniminium

C10H15N6O+

结构：Cc1ccc2c(N3CCC(N)CC3)nc(-c3ccccc3O)nc2c1

HCID136104957

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc2c(N3CCC(NC(=O)C4CCCO4)CC3)nc(-c3ccccc3O)nc2c1

HCID178422900

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c62f4dc140604ecf8eab2176696c62cc
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

[CH3:58][CH2:59][N:60]([CH2:61][CH3:62])[CH2:63][CH3:64].[NH2:33][CH:34]1[CH2:35][CH2:36][N:37]([c:40]2[n:41][c:42](-[c:51]3[c:52]([OH:57])[cH:53][cH:54][cH:55][cH:56]3)[n:43][c:44]3[cH:45][c:46]([CH3:50])[cH:47][cH:48][c:49]23)[CH2:38][CH2:39]1.[O:1]1[CH:2]([C:6](=[O:7])[OH:8])[CH2:3][CH2:4][CH2:5]1.[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[P-:9]([F:10])([F:11])([F:12])([F:13])([F:14])[F:15].[n:16]1([O:17][C:18]([N:19]([CH3:20])[CH3:21])=[N+:22]([CH3:23])[CH3:24])[c:25]2[n:26][cH:27][cH:28][cH:29][c:30]2[n:31][n:32]1>>[O:1]1[CH:2]([C:6](=[O:8])[NH:33][CH:34]2[CH2:35][CH2:36][N:37]([c:40]3[n:41][c:42](-[c:51]4[c:52]([OH:57])[cH:53][cH:54][cH:55][cH:56]4)[n:43][c:44]4[cH:45][c:46]([CH3:50])[cH:47][cH:48][c:49]34)[CH2:38][CH2:39]2)[CH2:3][CH2:4][CH2:5]1