Methanol → HCID 57911441, compound
Reaction equation
[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[CH3:53][OH:54].[CH3:55][CH2:56][O:57][C:58](=[O:59])[CH3:60].[F:16][C:17]([F:18])([F:19])[S:20]([O:21][C:22]1=[CH:23][c:24]2[c:25]([n:26][cH:27][cH:28][cH:29]2)[CH:30]([O:33][Si:34]([CH:35]([CH3:36])[CH3:37])([CH:38]([CH3:39])[CH3:40])[CH:41]([CH3:42])[CH3:43])[CH2:31][CH2:32]1)(=[O:44])=[O:45].[Na+:10].[Na+:11].[O-:12][C:13](=[O:14])[O-:15].[OH:1][B:2]([OH:3])[c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1.[cH:61]1[cH:62][cH:63][c:64]([P:65]([Pd:66]([P:67]([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)[c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)([P:86]([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)[P:105]([c:106]2[cH:107][cH:108][cH:109][cH:110][cH:111]2)([c:112]2[cH:113][cH:114][cH:115][cH:116][cH:117]2)[c:118]2[cH:119][cH:120][cH:121][cH:122][cH:123]2)([c:124]2[cH:125][cH:126][cH:127][cH:128][cH:129]2)[c:130]2[cH:131][cH:132][cH:133][cH:134][cH:135]2)[cH:136][cH:137]1>>[c:4]1([C:22]2=[CH:23][c:24]3[c:25]([n:26][cH:27][cH:28][cH:29]3)[CH:30]([O:33][Si:34]([CH:35]([CH3:36])[CH3:37])([CH:38]([CH3:39])[CH3:40])[CH:41]([CH3:42])[CH3:43])[CH2:31][CH2:32]2)[cH:5][cH:6][cH:7][cH:8][cH:9]1Participants
9
Sources & evidence
- ORD record
- ord-331aeb3c7fdf41f1b758ceea206c6581
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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