Ethanol → HCID 135457858, compound
Reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5](-[c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[c:6](-[c:13]3[cH:14][c:15]([CH3:18])[n:16][o:17]3)[c:7](=[O:12])[nH:8][c:9]2[cH:10][cH:11]1.[C:34](=[O:35])([O-:36])[O-:37].[CH3:120][c:121]1[cH:122][cH:123][cH:124][cH:125][cH:126]1.[CH3:40][CH2:41][OH:42].[Na+:38].[Na+:39].[c:25]1([B:31]([OH:32])[OH:33])[cH:26][cH:27][cH:28][cH:29][cH:30]1.[cH:43]1[cH:44][cH:45][c:46]([P:47]([Pd:48]([P:49]([c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)([c:56]2[cH:57][cH:58][cH:59][cH:60][cH:61]2)[c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([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)([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)[cH:118][cH:119]1>>[c:2]1(-[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:3][c:4]2[c:5](-[c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[c:6](-[c:13]3[cH:14][c:15]([CH3:18])[n:16][o:17]3)[c:7](=[O:12])[nH:8][c:9]2[cH:10][cH:11]1Participants
8
Sources & evidence
- ORD record
- ord-7a374834f3a6464f87ba2469ffcf6892
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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