Citric Acid → HCID 22467651, compound
Reaction equation
[C:31]1(=[O:41])[c:32]2[c:33]([cH:37][cH:38][cH:39][cH:40]2)[C:34](=[O:36])[NH:35]1.[CH3:1][O:2][c:3]1[c:4]([Cl:10])[cH:5][cH:6][c:7]([CH3:9])[cH:8]1.[Cl:56][C:57]([Cl:58])([Cl:59])[Cl:60].[K:42].[N:19]#[C:20][C:21]([N:22]=[N:23][C:24]([C:25]#[N:26])([CH3:27])[CH3:28])([CH3:29])[CH3:30].[O:11]=[C:12]1[N:13]([Br:14])[C:15](=[O:16])[CH2:17][CH2:18]1.[OH:43][C:44]([CH2:45][C:46]([C:47](=[O:48])[OH:49])([CH2:50][C:51](=[O:52])[OH:53])[OH:54])=[O:55]>>[CH3:1][O:2][c:3]1[c:4]([Cl:10])[cH:5][cH:6][c:7]([CH2:9][N:35]2[C:31](=[O:41])[c:32]3[c:33]([cH:37][cH:38][cH:39][cH:40]3)[C:34]2=[O:36])[cH:8]1Participants
8
Sources & evidence
- ORD record
- ord-6bbedecb95ba4c87803ea50fd2230b16
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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