Trifluoroacetic acid → HCID 22662046, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][O:8][c:9]1[c:10]([CH2:16][NH:17][c:18]2[c:19]3[n:20][cH:21][n:22]([CH:27]4[O:28][CH:29]([C:36]([NH:37][CH3:38])=[O:39])[CH:30]([N:33]=[N+:34]=[N-:35])[CH:31]4[OH:32])[c:23]3[n:24][cH:25][n:26]2)[cH:11][c:12]([Cl:15])[cH:13][cH:14]1)=[O:40].[OH:41][C:42]([C:43]([F:44])([F:45])[F:46])=[O:47]>>[O:5]=[C:6]([CH2:7][O:8][c:9]1[c:10]([CH2:16][NH:17][c:18]2[c:19]3[n:20][cH:21][n:22]([CH:27]4[O:28][CH:29]([C:36]([NH:37][CH3:38])=[O:39])[CH:30]([N:33]=[N+:34]=[N-:35])[CH:31]4[OH:32])[c:23]3[n:24][cH:25][n:26]2)[cH:11][c:12]([Cl:15])[cH:13][cH:14]1)[OH:40]Participants
3
Sources & evidence
- ORD record
- ord-ca0097f2717a4c898d02be60ae18d2a3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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