Ethanol → HCID 69586461, compound
Reaction equation
[C:37](=[O:38])([O-:39])[O-:40].[CH3:123][c:124]1[cH:125][cH:126][cH:127][cH:128][cH:129]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7]([NH2:20])[c:8]([S:10](=[O:11])(=[O:12])[c:13]2[cH:14][c:15]([Br:19])[cH:16][cH:17][cH:18]2)[cH:9]1.[CH3:43][CH2:44][OH:45].[Na+:41].[Na+:42].[c:21]1([CH3:36])[c:22](-[c:27]2[cH:28][cH:29][cH:30][cH:31][c:32]2[B:33]([OH:34])[OH:35])[cH:23][cH:24][cH:25][cH:26]1.[cH:46]1[cH:47][cH:48][c:49]([P:50]([Pd:51]([P:52]([c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([c:59]2[cH:60][cH:61][cH:62][cH:63][cH:64]2)[c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([P:71]([c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)[P:90]([c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)[c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)([c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)[c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[cH:121][cH:122]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[s:6][c:7]([NH2:20])[c:8]([S:10](=[O:11])(=[O:12])[c:13]2[cH:14][c:15](-[c:22]3[c:21]([CH3:36])[cH:26][cH:25][cH:24][cH:23]3)[cH:16][cH:17][cH:18]2)[cH:9]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-8b8770122751412a8c13f09682227004
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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