Citric Acid → HCID 86589685, compound

HRID 2136901Notes

Reaction equation

HRID 2136901 reaction equation
[CH2:44]1[CH2:45][O:46][CH2:47][CH2:48][NH:49]1.[Cl:63][CH2:64][Cl:65].[OH:50][C:51]([CH2:52][C:53]([C:54](=[O:55])[OH:56])([CH2:57][C:58](=[O:59])[OH:60])[OH:61])=[O:62].[n:1]1([O:10][C:11](=[O:2])[C:12](=[CH:13][c:14]2[cH:15][c:16]([CH3:21])[cH:17][c:18]([CH3:20])[cH:19]2)[c:22]2[cH:23][cH:24][c:25]([O:28][c:29]3[cH:30][cH:31][c:32]([CH2:35][CH:36]4[C:37](=[O:42])[NH:38][C:39](=[O:41])[S:40]4)[cH:33][cH:34]3)[cH:26][cH:27]2)[c:3]2[cH:4][cH:5][cH:6][cH:7][c:8]2[n:9][n:43]1>>[O:10]=[C:11]([C:12](=[CH:13][c:14]1[cH:15][c:16]([CH3:21])[cH:17][c:18]([CH3:20])[cH:19]1)[c:22]1[cH:23][cH:24][c:25]([O:28][c:29]2[cH:30][cH:31][c:32]([CH2:35][CH:36]3[C:37](=[O:42])[NH:38][C:39](=[O:41])[S:40]3)[cH:33][cH:34]2)[cH:26][cH:27]1)[N:49]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1

Participants

5

Sources & evidence

ORD record
ord-06fd75c804ec4277829130ba07ea6c71
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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