HRID169633

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

3 次

HCID962

Water

H2O

HCID1061

Phosphate

O4P-3

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8028

Tetrahydrofuran

C4H8O

结构：O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc(Cl)ncc1Cl

HCID11416492

未命名化合物

结构：C=CCN(CCCO[Si](C)(C)C(C)(C)C)C(=O)OC(C)(C)C

HCID86595927

未命名化合物

结构：c1ccc([PH](c2ccccc2)(c2ccccc2)[Pd]([PH](c2ccccc2)(c2ccccc2)c2ccccc2)([PH](c2ccccc2)(c2ccccc2)c2ccccc2)[PH](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

HCID178420554

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N(CCCO[Si](C)(C)C(C)(C)C)CCCc1cc(C(=O)NCC23CC4CC(CC(C4)C2)C3)c(Cl)cn1

HCID69586523

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8515f2e4f45946fd9ae97df85ffab0b5
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

[C:31]12([CH2:41][NH:42][C:43]([c:44]3[cH:45][c:46]([Cl:51])[n:47][cH:48][c:49]3[Cl:50])=[O:52])[CH2:32][CH:33]3[CH2:34][CH:35]([CH2:36][CH:37]([CH2:38]1)[CH2:39]3)[CH2:40]2.[CH2:1]([CH:2]=[CH2:3])[N:4]([C:5]([O:6][C:7]([CH3:8])([CH3:9])[CH3:10])=[O:11])[CH2:12][CH2:13][CH2:14][O:15][Si:16]([CH3:17])([CH3:18])[C:19]([CH3:20])([CH3:21])[CH3:22].[CH3:59][N:60]([CH3:61])[CH:62]=[O:63].[K+:28].[K+:29].[K+:30].[O:53]1[CH2:54][CH2:55][CH2:56][CH2:57]1.[OH2:58].[P:23]([O-:24])([O-:25])([O-:26])=[O:27].[cH:64]1[cH:65][cH:66][c:67]([P:68]([Pd:69]([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)([P:89]([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[P:108]([c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)([c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)([c:127]2[cH:128][cH:129][cH:130][cH:131][cH:132]2)[c:133]2[cH:134][cH:135][cH:136][cH:137][cH:138]2)[cH:139][cH:140]1>>[CH2:1]([CH2:2][CH2:3][c:46]1[cH:45][c:44]([C:43]([NH:42][CH2:41][C:31]23[CH2:32][CH:33]4[CH2:34][CH:35]([CH2:36][CH:37]([CH2:38]2)[CH2:39]4)[CH2:40]3)=[O:52])[c:49]([Cl:50])[cH:48][n:47]1)[N:4]([C:5]([O:6][C:7]([CH3:8])([CH3:9])[CH3:10])=[O:11])[CH2:12][CH2:13][CH2:14][O:15][Si:16]([CH3:17])([CH3:18])[C:19]([CH3:20])([CH3:21])[CH3:22]