Ethanol → HCID 67214482, compound
Reaction equation
[C:27](=[O:28])([O-:29])[O-:30].[CH3:113][c:114]1[cH:115][cH:116][cH:117][cH:118][cH:119]1.[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([C:7](=[O:8])[NH:9][CH2:10][CH2:11][CH3:12])[cH:13][c:14]([Br:16])[cH:15]1)=[O:17].[CH3:33][CH2:34][OH:35].[Na+:31].[Na+:32].[c:18]1([B:24]([OH:25])[OH:26])[cH:19][cH:20][cH:21][cH:22][cH:23]1.[cH:36]1[cH:37][cH:38][c:39]([P:40]([Pd:41]([P:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([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)[P:80]([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)([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)[c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[cH:111][cH:112]1>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([C:7](=[O:8])[NH:9][CH2:10][CH2:11][CH3:12])[cH:13][c:14](-[c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:15]1)=[O:17]Participants
8
Sources & evidence
- ORD record
- ord-79911634ae21440dad18909212012a45
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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