HRID823398

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID9886

Hexafluorophosphate ion

F6P-

HCID81531

Diisopropylethylamine

C8H19N

HCID4641409

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

C10H15N6O+

HCID17825054

N-Methylhex-5-en-1-amine

C7H15N

结构：C=CC1CC1(NC(=O)C1CC(Oc2nc(-c3cccc(F)c3)nc3c(C)c(OC)ccc23)CC1C(=O)O)C(=O)OCC

HCID68686580

未命名化合物

PRODUCTS

生成物

结构：C=CCCCCN(C)C(=O)C1CC(Oc2nc(-c3cccc(F)c3)nc3c(C)c(OC)ccc23)CC1C(=O)NC1(C(=O)OCC)CC1C=C

HCID68412435

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c5b0e08c02f6433f92532d1a0db91f4e
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([NH:11][C:12](=[O:13])[CH:14]2[CH:15]([C:40](=[O:41])[OH:42])[CH2:16][CH:17]([O:19][c:20]3[n:21][c:22](-[c:33]4[cH:34][c:35]([F:39])[cH:36][cH:37][cH:38]4)[n:23][c:24]4[c:25]([CH3:32])[c:26]([O:30][CH3:31])[cH:27][cH:28][c:29]34)[CH2:18]2)[CH:7]([CH:9]=[CH2:10])[CH2:8]1.[CH2:44]([CH2:45][CH2:46][CH2:47][CH:48]=[CH2:49])[NH:50][CH3:51].[CH:52]([N:53]([CH2:54][CH3:55])[CH:56]([CH3:57])[CH3:58])([CH3:59])[CH3:60].[ClH:43].[O:85]=[CH:86][N:87]([CH3:88])[CH3:89].[P-:61]([F:62])([F:63])([F:64])([F:65])([F:66])[F:67].[n:68]1([O:69][C:70]([N:71]([CH3:72])[CH3:73])=[N+:74]([CH3:75])[CH3:76])[c:77]2[n:78][cH:79][cH:80][cH:81][c:82]2[n:83][n:84]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([NH:11][C:12](=[O:13])[CH:14]2[CH:15]([C:40](=[O:42])[N:50]([CH2:44][CH2:45][CH2:46][CH2:47][CH:48]=[CH2:49])[CH3:51])[CH2:16][CH:17]([O:19][c:20]3[n:21][c:22](-[c:33]4[cH:34][c:35]([F:39])[cH:36][cH:37][cH:38]4)[n:23][c:24]4[c:25]([CH3:32])[c:26]([O:30][CH3:31])[cH:27][cH:28][c:29]34)[CH2:18]2)[CH:7]([CH:9]=[CH2:10])[CH2:8]1