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Potassium Cation → HCID 178518236, 화합물

HRID 2331717
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HRID 2331717 반응식
[Br:12][c:13]1[cH:14][c:15]([C:16]([O:17][CH3:18])=[O:19])[nH:20][cH:21]1.[Br:1][c:2]1[cH:3][c:4]2[c:5]([OH:11])[n:6][cH:7][n:8][n:9]2[cH:10]1.[CH3:22][C:23]1([CH3:24])[C:25]([CH3:26])([CH3:27])[O:28][B:29]([c:30]2[cH:31][c:32]([N:36]3[CH2:37][CH2:38][O:39][CH2:40][CH2:41]3)[n:33][cH:34][cH:35]2)[O:42]1.[Cl:131][CH2:132][Cl:133].[K+:43].[K+:44].[O-:45][C:46]([O-:47])=[O:48].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[cH:54]1[cH:55][cH:56][c:57]([P:58]([Pd:59]([P:60]([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)([P:79]([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[P:98]([c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)([c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)([c:117]2[cH:118][cH:119][cH:120][cH:121][cH:122]2)[c:123]2[cH:124][cH:125][cH:126][cH:127][cH:128]2)[cH:129][cH:130]1>>[c:2]1(-[c:30]2[cH:31][c:32]([N:36]3[CH2:37][CH2:38][O:39][CH2:40][CH2:41]3)[n:33][cH:34][cH:35]2)[cH:3][c:4]2[c:5]([OH:11])[n:6][cH:7][n:8][n:9]2[cH:10]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 813Potassium Cation2회HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 2763594Methyl 4-bromo-1H-pyrrole-2-carboxylateHCID 210816614-(4-(Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)morpholine
HCID 178420554
HCID 178420554, 화합물
HCID 178518234HCID 178518234, 화합물

생성물 1

HCID 178518236HCID 178518236, 화합물

출처 및 근거

ORD 기록
ord-f966303ed66e4bf48fc65e171be60cee
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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