Sodium ion → 4-[4-amino-3-(3-methoxy-4-[(1-methyl-1H-2-indolyl)-carbonyl]aminophenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]-1-pyridiniumolate
Reaction equation
[CH2:55]([CH2:56][O:57][CH3:58])[O:59][CH3:60].[CH3:19][O:20][c:21]1[c:22]([NH:36][C:37](=[O:38])[c:39]2[n:40]([CH3:48])[c:41]3[cH:42][cH:43][cH:44][cH:45][c:46]3[cH:47]2)[cH:23][cH:24][c:25]([B:27]2[O:28][C:29]([CH3:30])([CH3:31])[C:32]([CH3:33])([CH3:34])[O:35]2)[cH:26]1.[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8](-[c:12]1[cH:13][cH:14][n+:15]([O-:18])[cH:16][cH:17]1)[n:9][c:10]2[I:11].[Na+:49].[Na+:50].[O-:51][C:52](=[O:53])[O-:54].[OH2:61].[cH:62]1[cH:63][cH:64][c:65]([P:66]([Pd:67]([P:68]([c:69]2[cH:70][cH:71][cH:72][cH:73][cH:74]2)([c:75]2[cH:76][cH:77][cH:78][cH:79][cH:80]2)[c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)([P:87]([c:88]2[cH:89][cH:90][cH:91][cH:92][cH:93]2)([c:94]2[cH:95][cH:96][cH:97][cH:98][cH:99]2)[c:100]2[cH:101][cH:102][cH:103][cH:104][cH:105]2)[P:106]([c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)([c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)[c:119]2[cH:120][cH:121][cH:122][cH:123][cH:124]2)([c:125]2[cH:126][cH:127][cH:128][cH:129][cH:130]2)[c:131]2[cH:132][cH:133][cH:134][cH:135][cH:136]2)[cH:137][cH:138]1>>[NH2:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[n:8](-[c:12]1[cH:13][cH:14][n+:15]([O-:18])[cH:16][cH:17]1)[n:9][c:10]2-[c:25]1[cH:24][cH:23][c:22]([NH:36][C:37](=[O:38])[c:39]2[n:40]([CH3:48])[c:41]3[cH:42][cH:43][cH:44][cH:45][c:46]3[cH:47]2)[c:21]([O:20][CH3:19])[cH:26]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-fdb0d49c147548618bda238ed6c921ea
- Source dataset
- Validation data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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