Ethanol → HCID 58028440, compound
Reaction equation
[Br:9][c:10]1[cH:11][c:12]([F:21])[c:13]([CH2:16][CH2:17][CH2:18][CH2:19][CH3:20])[cH:14][cH:15]1.[CH2:41]([OH:42])[CH3:43].[CH3:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[Na+:22].[OH2:121].[OH:23][C:24](=[O:25])[O-:26].[c:34]1([CH3:35])[cH:36][cH:37][cH:38][cH:39][cH:40]1.[cH:44]1[cH:45][cH:46][c:47]([P:48]([Pd:49]([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[P:88]([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)([c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)[cH:119][cH:120]1.[s:1]1[c:2]([B:6]([OH:7])[OH:8])[cH:3][cH:4][cH:5]1>>[s:1]1[c:2](-[c:10]2[cH:11][c:12]([F:21])[c:13]([CH2:16][CH2:17][CH2:18][CH2:19][CH3:20])[cH:14][cH:15]2)[cH:3][cH:4][cH:5]1Participants
9
Sources & evidence
- ORD record
- ord-6a2ed4b8e8ad41cfa9b84fd67a19b45f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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