Ethanol → HCID 67103012, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:11](=[O:12])[NH:13][CH2:14][CH2:15][CH2:16][O:17][CH3:18])[cH:19][c:20]([Br:31])[c:21]([O:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:22]1.[CH3:135][CH2:136][OH:137].[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[CH:32]([CH3:33])([CH3:34])[c:35]1[cH:36][cH:37][c:38]([O:44][CH3:45])[c:39]([B:41]([OH:42])[OH:43])[cH:40]1.[Na+:57].[O-:53][C:54]([OH:55])=[O:56].[cH:58]1[cH:59][cH:60][c:61]([P:62]([Pd:63]([P:64]([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)([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)([P:83]([c:84]2[cH:85][cH:86][cH:87][cH:88][cH:89]2)([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)[P:102]([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)([c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)[c:127]2[cH:128][cH:129][cH:130][cH:131][cH:132]2)[cH:133][cH:134]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:11](=[O:12])[NH:13][CH2:14][CH2:15][CH2:16][O:17][CH3:18])[cH:19][c:20](-[c:39]2[c:38]([O:44][CH3:45])[cH:37][cH:36][c:35]([CH:32]([CH3:33])[CH3:34])[cH:40]2)[c:21]([O:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:22]1Participants
8
Sources & evidence
- ORD record
- ord-b0524d8f08f843318e0b8197181dbc61
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…