Citric Acid → HCID 13670774, compound
Reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][c:6]2[c:12]([s:13]1)-[n:11]1[c:10]([n:16][n:15][c:14]1[CH3:17])[CH2:9][N:8]=[C:7]2[c:18]1[c:19]([Cl:24])[cH:20][cH:21][cH:22][cH:23]1.[Cl:25][O-:26].[Na+:27].[Na+:28].[OH:29][S:30](=[O:31])[O-:32].[OH:33][C:34]([CH2:35][C:36]([C:37](=[O:38])[OH:39])([CH2:40][C:41](=[O:42])[OH:43])[OH:44])=[O:45]>>[C:1](=[O:3])([c:4]1[cH:5][c:6]2[c:12]([s:13]1)-[n:11]1[c:10]([n:16][n:15][c:14]1[CH3:17])[CH2:9][N:8]=[C:7]2[c:18]1[c:19]([Cl:24])[cH:20][cH:21][cH:22][cH:23]1)[OH:29]Participants
6
Sources & evidence
- ORD record
- ord-a3eb72e54c094a86af7169168d57aefa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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