Ethanol → HCID 11750889, compound
Reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([s:25]1)[CH2:6][CH2:7][c:8]1[cH:9][n:10][c:11]([NH:14][c:15]3[cH:16][c:17]([S:21](=[O:22])(=[O:23])[NH2:24])[cH:18][cH:19][cH:20]3)[n:12][c:13]1-2.[C:35](=[O:36])([O-:37])[O-:38].[CH3:122][O:123][CH2:124][CH2:125][O:126][CH3:127].[CH3:41][CH2:42][OH:43].[Na+:39].[Na+:40].[OH2:44].[c:26]1([B:32]([OH:33])[OH:34])[cH:27][cH:28][cH:29][cH:30][cH:31]1.[cH:45]1[cH:46][cH:47][c:48]([P:49]([Pd:50]([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[P:89]([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[cH:120][cH:121]1>>[c:2]1(-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[cH:3][c:4]2[c:5]([s:25]1)[CH2:6][CH2:7][c:8]1[cH:9][n:10][c:11]([NH:14][c:15]3[cH:16][c:17]([S:21](=[O:22])(=[O:23])[NH2:24])[cH:18][cH:19][cH:20]3)[n:12][c:13]1-2Participants
9
Sources & evidence
- ORD record
- ord-9e2298c1041642239effe9ce39e8e0c2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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