Ethanol → HCID 68959363, compound
Reaction equation
[Br:11][c:12]1[cH:13][c:14]([NH:22][c:23]2[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]2)[c:15]([C:16](=[O:17])[O:18][CH3:19])[cH:20][cH:21]1.[C:30](=[O:31])([O-:32])[OH:33].[CH3:113][CH2:114][O:115][C:116](=[O:117])[CH3:118].[CH3:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[CH3:8][CH2:9][OH:10].[Na+:34].[OH2:112].[cH:35]1[cH:36][cH:37][c:38]([P:39]([Pd:40]([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)[c:54]2[cH:55][cH:56][cH:57][cH:58][cH:59]2)([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)([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)[cH:110][cH:111]1>>[CH:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)=[CH:8][c:12]1[cH:13][c:14]([NH:22][c:23]2[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]2)[c:15]([C:16](=[O:17])[O:18][CH3:19])[cH:20][cH:21]1Participants
9
Sources & evidence
- ORD record
- ord-267374d986364f39afdedfdf1c3f8e7e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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