Citric Acid → HCID 178473640, compound
Reaction equation
[C:48]([OH:49])(=[O:50])[CH2:51][C:52]([CH2:53][C:54]([OH:55])=[O:56])([C:57]([OH:58])=[O:59])[OH:60].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[n:11]1[n:12][c:13]([O:28][CH:29]2[CH:30]([OH:31])[CH:32]([OH:33])[CH:34]([OH:35])[CH:36]([CH2:38][OH:39])[O:37]2)[c:14]([CH2:17][c:18]2[cH:19][cH:20][c:21]([O:24][CH:25]([CH3:26])[CH3:27])[cH:22][cH:23]2)[c:15]1[CH3:16].[CH3:61][c:62]1[cH:63][c:64]([CH3:65])[cH:66][c:67]([CH3:68])[n:69]1.[Cl:40][C:41](=[O:42])[O:43][CH2:44][CH3:45].[OH2:46].[OH2:47]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[n:11]1[n:12][c:13]([O:28][CH:29]2[CH:30]([OH:31])[CH:32]([OH:33])[CH:34]([OH:35])[CH:36]([CH2:38][O:39][C:41](=[O:42])[O:43][CH2:44][CH3:45])[O:37]2)[c:14]([CH2:17][c:18]2[cH:19][cH:20][c:21]([O:24][CH:25]([CH3:26])[CH3:27])[cH:22][cH:23]2)[c:15]1[CH3:16]Participants
6
Sources & evidence
- ORD record
- ord-dc9a9ddcb8ea459fab55af8149881adb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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