Potassium Cation → HCID 16123061, compound
Reaction equation
[K+:26].[K+:27].[NH2:1][c:2]1[n:3][c:4]([CH3:17])[c:5]2[c:6]([n:7]1)[n:8]([CH:14]([CH3:15])[CH3:16])[c:9](=[O:13])[c:10]([Br:12])[cH:11]2.[O-:28][C:29]([O-:30])=[O:31].[O:32]1[CH2:33][CH2:34][O:35][CH2:36][CH2:37]1.[OH2:38].[Pd:39].[c:40]1([P:41]([c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[c:48]2[cH:49][cH:50][cH:51][cH:52][cH:53]2)[cH:54][cH:55][cH:56][cH:57][cH:58]1.[c:59]1([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)[cH:73][cH:74][cH:75][cH:76][cH:77]1.[c:78]1([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)[cH:92][cH:93][cH:94][cH:95][cH:96]1.[c:97]1([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)[cH:111][cH:112][cH:113][cH:114][cH:115]1.[nH:18]1[n:19][c:20]([B:23]([OH:24])[OH:25])[cH:21][cH:22]1>>[NH2:1][c:2]1[n:3][c:4]([CH3:17])[c:5]2[c:6]([n:7]1)[n:8]([CH:14]([CH3:15])[CH3:16])[c:9](=[O:13])[c:10](-[c:20]1[nH:19][n:18][cH:22][cH:21]1)[cH:11]2Participants
9
Sources & evidence
- ORD record
- ord-0a783d1df76d4359949a625126f53ddd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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