Potassium Cation → HCID 86637302, compound
Reaction equation
[CH2:41]1[O:42][CH2:43][CH2:44][O:45][CH2:46]1.[CH3:48][CH2:49][O:50][C:51]([CH3:52])=[O:53].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6]([Cl:8])[n:7]1.[K+:38].[K+:39].[K+:40].[O:9]1[CH2:10][CH2:11][CH:12]([CH:15]([CH2:16][C:17]#[N:18])[n:19]2[n:20][cH:21][c:22]([B:24]3[O:25][C:26]([CH3:27])([CH3:28])[C:29]([CH3:30])([CH3:31])[O:32]3)[cH:23]2)[CH2:13][CH2:14]1.[OH2:47].[P:33]([O-:34])([O-:35])([O-:36])=[O:37].[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>>[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:22]2[cH:21][n:20][n:19]([CH:15]([CH:12]3[CH2:11][CH2:10][O:9][CH2:14][CH2:13]3)[CH2:16][C:17]#[N:18])[cH:23]2)[n:7]1Participants
9
Sources & evidence
- ORD record
- ord-81df2221c51b4cb68a9ef58a951c1ddb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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