Acetic Acid → HCID 13134784, compound
Reaction equation
[CH3:24][CH2:25][OH:26].[CH3:29][C:30](=[O:31])[OH:32].[NH2:22][NH2:23].[Na+:28].[O:1]=[C:2]1[c:3]2[c:4]([cH:13][cH:14][c:15]([CH2:17][C:18](=[O:19])[OH:20])[cH:16]2)[S:5][c:6]2[c:7]([cH:9][cH:10][cH:11][n:12]2)[CH2:8]1.[OH-:27].[OH2:21].[OH2:33].[OH:34][CH2:35][CH2:36][O:37][CH2:38][CH2:39][OH:40]>>[CH2:2]1[c:3]2[c:4]([cH:13][cH:14][c:15]([CH2:17][C:18](=[O:19])[OH:20])[cH:16]2)[S:5][c:6]2[c:7]([cH:9][cH:10][cH:11][n:12]2)[CH2:8]1Participants
9
Sources & evidence
- ORD record
- ord-020accd86fb046809dc0a1e318dd1b97
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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