Acetic Acid → HCID 18341464, compound
Reaction equation
[C:98]([OH:99])(=[O:100])[CH3:101].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([CH2:10][CH:11]([C:12](=[O:13])[NH:14][CH:15]([CH2:16][OH:17])[CH2:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[n:25]1[cH:26][c:27](-[c:30]2[cH:31][cH:32][c:33](-[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[cH:34][cH:35]2)[cH:28][cH:29]1)=[O:42].[CH2:43]([O:44][C:45](=[O:46])[CH2:47][CH:48]([NH:49][C:50]([O:51][C:52]([CH3:53])([CH3:54])[CH3:55])=[O:56])[C:57]([NH:58][CH:59]([CH2:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1)[CH2:67][O:68][CH3:69])=[O:70])[c:71]1[cH:72][cH:73][cH:74][cH:75][cH:76]1.[c:77]1(-[c:78]2[cH:79][cH:80][cH:81][cH:82][cH:83]2)[cH:84][cH:85][c:86]([CH:87]2[CH2:88][CH:89]([O:90][CH3:91])[O:92][CH:93]2[O:94][CH3:95])[cH:96][cH:97]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([CH2:10][CH:11]([C:12](=[O:13])[NH:14][CH:15]([CH2:16][O:17][CH3:43])[CH2:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[n:25]1[cH:26][c:27](-[c:30]2[cH:31][cH:32][c:33](-[c:36]3[cH:37][cH:38][cH:39][cH:40][cH:41]3)[cH:34][cH:35]2)[cH:28][cH:29]1)=[O:42]Participants
5
Sources & evidence
- ORD record
- ord-07371509f27b43d387585db4fc53535b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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