Citric Acid → HCID 66657392, compound
Reaction equation
[CH2:1]([CH3:2])[N:3]([c:4]1[n:5][c:6]([NH:24][c:25]2[n:26][cH:27][cH:28][c:29]([CH3:31])[cH:30]2)[c:7]2[c:8]([n:9]1)[c:10]([C:21](=[O:22])[OH:23])[n:11][n:12]2[CH2:13][CH2:14][O:15][CH2:16][C:17]([F:18])([F:19])[F:20])[CH3:32].[CH3:34][N:35]([CH3:36])[CH2:37][CH2:38][CH2:39][N:40]=[C:41]=[N:42][CH2:43][CH3:44].[CH3:45][S:46](=[O:47])(=[O:48])[NH2:49].[CH3:50][N:51]([CH3:52])[c:53]1[cH:54][cH:55][n:56][cH:57][cH:58]1.[Cl:59][CH2:60][Cl:61].[ClH:33].[OH:62][C:63]([CH2:64][C:65]([C:66](=[O:67])[OH:68])([CH2:69][C:70](=[O:71])[OH:72])[OH:73])=[O:74]>>[CH2:1]([CH3:2])[N:3]([c:4]1[n:5][c:6]([NH:24][c:25]2[n:26][cH:27][cH:28][c:29]([CH3:31])[cH:30]2)[c:7]2[c:8]([n:9]1)[c:10]([C:21](=[O:23])[NH:49][S:46]([CH3:45])(=[O:47])=[O:48])[n:11][n:12]2[CH2:13][CH2:14][O:15][CH2:16][C:17]([F:18])([F:19])[F:20])[CH3:32]Participants
8
Sources & evidence
- ORD record
- ord-749f6e46ea6c499d9b54a574f0b70a57
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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