Citric Acid → HCID 66990073, compound
Reaction equation
[C:3]([CH3:4])([CH3:5])([CH3:6])[O:7][C:8](=[O:9])[N:10]([c:11]1[c:12](-[c:17]2[cH:18][c:19]([NH:27][C:28](=[O:29])[c:30]3[cH:31][n:32][cH:33][c:34](-[c:36]4[cH:37][cH:38][cH:39][cH:40][cH:41]4)[cH:35]3)[c:20]([C:21](=[O:22])[O:23][CH3:24])[cH:25][cH:26]2)[cH:13][cH:14][cH:15][cH:16]1)[CH2:42][CH3:43].[CH3:61][OH:62].[CH:57]([Cl:58])([Cl:59])[Cl:60].[Na+:2].[O:63]1[CH2:64][CH2:65][O:66][CH2:67][CH2:68]1.[OH-:1].[OH:44][C:45]([CH2:46][C:47]([C:48](=[O:49])[OH:50])([CH2:51][C:52](=[O:53])[OH:54])[OH:55])=[O:56]>>[C:3]([CH3:4])([CH3:5])([CH3:6])[O:7][C:8](=[O:9])[N:10]([c:11]1[c:12](-[c:17]2[cH:18][c:19]([NH:27][C:28](=[O:29])[c:30]3[cH:31][n:32][cH:33][c:34](-[c:36]4[cH:37][cH:38][cH:39][cH:40][cH:41]4)[cH:35]3)[c:20]([C:21](=[O:22])[OH:23])[cH:25][cH:26]2)[cH:13][cH:14][cH:15][cH:16]1)[CH2:42][CH3:43]Participants
8
Sources & evidence
- ORD record
- ord-a4730d8df01e4f8d8a26c4fb41a70165
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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