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Sodium Ion → HCID 11510032, 화합물

HRID 2311743
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HRID 2311743 반응식
[C:43](=[O:44])([O-:45])[O-:46].[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH:12]1[CH2:13][CH:14]([CH2:16][OH:17])[CH2:15]1)[cH:9][c:10]2[I:11].[Na+:47].[Na+:48].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[c:18]1(-[c:24]2[n:25][c:26]3[cH:27][c:28]([B:34]4[O:35][C:36]([CH3:37])([CH3:38])[C:39]([CH3:40])([CH3:41])[CH2:42]4)[cH:29][cH:30][c:31]3[cH:32][cH:33]2)[cH:19][cH:20][cH:21][cH:22][cH:23]1.[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>>[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8]([CH:12]1[CH2:13][CH:14]([CH2:16][OH:17])[CH2:15]1)[cH:9][c:10]2-[c:28]1[cH:27][c:26]2[n:25][c:24](-[c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[cH:33][cH:32][c:31]2[cH:30][cH:29]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 923Sodium Ion2회HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 57680955HCID 57680955, 화합물HCID 688304652-Phenyl-7-(4,4,5,5-tetramethyl-[2,3,2]dioxaborolan-2-yl)-quinolineHCID 178420554HCID 178420554, 화합물

생성물 1

HCID 11510032
HCID 11510032, 화합물

출처 및 근거

ORD 기록
ord-0e07b8d153e34667831f7dd78cdce469
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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