HRID311513

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID9886

Hexafluorophosphate ion

F6P-

HCID11671

2-Hydroxyisobutyric acid

C4H8O3

HCID143452

tert-Butyl piperazine-1-carboxylate

C9H18N2O2

HCID4641409

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

C10H15N6O+

HCID66639690

未命名化合物

PRODUCTS

生成物

HCID21949293

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c3b58a8e36a04193a491663e1b8c3fcf
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

[CH3:35][C:36]([CH3:37])([OH:38])[C:39](=[O:40])[OH:41].[CH3:73][CH2:74][N:75]([CH2:76][CH3:77])[CH2:78][CH3:79].[ClH:66].[N:22]1([C:28]([O:30][C:29]([CH3:31])([CH3:32])[CH3:33])=[O:34])[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1.[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[OH2:72].[P-:42]([F:43])([F:44])([F:45])([F:46])([F:47])[F:48].[cH:1]1[c:2]2[c:18]([cH:19][cH:20][cH:21]1)[CH:17]=[CH:16][CH2:15][n:14]1[c:3]-2[cH:4][c:5]2[cH:6][cH:7][c:8]([C:9]([NH2:10])=[O:11])[cH:12][c:13]21.[n:49]1([O:50][C:51]([N:52]([CH3:53])[CH3:54])=[N+:55]([CH3:56])[CH3:57])[c:58]2[n:59][cH:60][cH:61][cH:62][c:63]2[n:64][n:65]1>>[N:22]1([C:28](=[O:30])[C:36]([CH3:35])([CH3:37])[OH:38])[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1