Acetic Acid → HCID 23036351, compound
Reaction equation
[C:41](=[O:42])([OH:43])[O-:44].[CH2:1]([CH3:2])[O:3][C:4]([C:5](=[O:6])[NH:7][c:8]1[cH:9][cH:10][c:11]([O:14][CH2:15][CH2:16][CH2:17][N:18]2[CH2:19][CH2:20][CH:21]([C:24]([OH:25])([c:26]3[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]3)[c:33]3[cH:34][cH:35][c:36]([F:39])[cH:37][cH:38]3)[CH2:22][CH2:23]2)[cH:12][cH:13]1)=[O:40].[CH3:47][C:48](=[O:49])[OH:50].[CH3:51][CH2:52][OH:53].[Na+:45].[OH2:46]>>[O:3]=[C:4]([C:5](=[O:6])[NH:7][c:8]1[cH:9][cH:10][c:11]([O:14][CH2:15][CH2:16][CH2:17][N:18]2[CH2:19][CH2:20][CH:21]([C:24]([OH:25])([c:26]3[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]3)[c:33]3[cH:34][cH:35][c:36]([F:39])[cH:37][cH:38]3)[CH2:22][CH2:23]2)[cH:12][cH:13]1)[OH:40]Participants
7
Sources & evidence
- ORD record
- ord-d7ae5f062f804694b268a4b1c922de03
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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