Citric Acid → HCID 68480331, compound
Reaction equation
[Br:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][O:20][C:21]([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[C:4]([CH2:5][C:6](=[O:7])[O:8][CH3:9])(=[O:10])[O:11][CH3:12].[CH3:1][O-:2].[CH3:53][OH:54].[Na+:3].[OH:40][C:41]([CH2:42][C:43]([C:44](=[O:45])[OH:46])([CH2:47][C:48](=[O:49])[OH:50])[OH:51])=[O:52]>>[C:4]([CH:5]([C:6](=[O:7])[O:8][CH3:9])[CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][O:20][C:21]([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1)(=[O:10])[O:11][CH3:12]Participants
7
Sources & evidence
- ORD record
- ord-b3c05bfde9064a138f8a74d1e171cffe
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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