Acetic Acid → HCID 19100734, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[s:10][cH:11][c:12]([CH2:19][CH:20]([CH3:21])[CH3:22])[c:13]1[C:14](=[O:15])[O:16][CH2:17][CH3:18].[C:23]([O:24][C:25]([N:26]([C:27]([O:28][C:29]([CH3:30])([CH3:31])[CH3:32])=[O:33])[c:34]1[s:35][cH:36][c:37]([CH2:38][CH:39]([CH3:40])[CH3:41])[c:42]1[C:43]([O:44][CH2:45][CH3:46])=[O:47])=[O:48])([CH3:49])([CH3:50])[CH3:51].[CH3:54][C:55](=[O:56])[OH:57].[CH3:58][OH:59].[K+:53].[OH-:52].[OH2:60]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][c:9]1[s:10][cH:11][c:12]([CH2:19][CH:20]([CH3:21])[CH3:22])[c:13]1[C:14](=[O:15])[OH:16]Participants
8
Sources & evidence
- ORD record
- ord-5730eeba2a1841aebdaa7d018d45a3c4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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