Ethanol → HCID 68964188, compound
Reaction equation
[Br:38][c:39]1[cH:40][cH:41][c:42]2[c:43]([cH:44][cH:45][s:46]2)[cH:47]1.[C:48](=[O:49])([O-:50])[OH:51].[CH3:131][CH2:132][O:133][C:134](=[O:135])[CH3:136].[CH3:137][CH2:138][OH:139].[CH3:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[F:8][c:9]1[cH:10][cH:11][c:12]([NH:13][c:14]2[c:15]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[cH:23][cH:24][c:25]([B:27]3[O:28][C:29]([CH3:30])([CH3:31])[C:32]([CH3:33])([CH3:34])[O:35]3)[cH:26]2)[cH:36][cH:37]1.[Na+:52].[OH2:130].[cH:53]1[cH:54][cH:55][c:56]([P:57]([Pd:58]([P:59]([c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([P:78]([c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)[c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)[P:97]([c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)([c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)[c:110]2[cH:111][cH:112][cH:113][cH:114][cH:115]2)([c:116]2[cH:117][cH:118][cH:119][cH:120][cH:121]2)[c:122]2[cH:123][cH:124][cH:125][cH:126][cH:127]2)[cH:128][cH:129]1>>[F:8][c:9]1[cH:10][cH:11][c:12]([NH:13][c:14]2[c:15]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[cH:23][cH:24][c:25](-[c:39]3[cH:40][cH:41][c:42]4[c:43]([cH:44][cH:45][s:46]4)[cH:47]3)[cH:26]2)[cH:36][cH:37]1Participants
10
Sources & evidence
- ORD record
- ord-c06b4e4ccf41460fa70e58fff28b219e
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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