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Bicarbonate Ion → HCID 59448347, 화합물

HRID 191931
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HRID 191931 반응식
[C:9](=[O:10])([OH:11])[O-:12].[CH3:14][O:15][c:16]1[n:17][cH:18][c:19]([B:24]([OH:25])[OH:26])[c:20]([O:22][CH3:23])[n:21]1.[CH3:27][O:28][CH2:29][CH2:30][O:31][CH3:32].[Cl:33][CH2:34][Cl:35].[I:1][c:2]1[s:3][c:4]([CH3:8])[c:5]([CH3:7])[n:6]1.[Na+:13].[cH:36]1[cH:37][cH:38][c:39]([P:40]([Pd:41]([P:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[P:80]([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)([c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)[c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)([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)[cH:111][cH:112]1>>[c:2]1(-[c:19]2[cH:18][n:17][c:16]([O:15][CH3:14])[n:21][c:20]2[O:22][CH3:23])[s:3][c:4]([CH3:8])[c:5]([CH3:7])[n:6]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 6344DichloromethaneHCID 80711,2-DimethoxyethaneHCID 2736209(2,4-Dimethoxypyrimidin-5-yl)boronic acidHCID 21100233Thiazole, 2-iodo-4,5-dimethyl-HCID 178420554HCID 178420554, 화합물

생성물 1

HCID 59448347HCID 59448347, 화합물

출처 및 근거

ORD 기록
ord-a6aa9784ffb0408f9fd5030c841e0f39
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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