2-Butenedioic acid → HCID 13883831, compound
Reaction equation
[C:1]([OH:2])(=[O:3])[CH:4]=[CH:5][C:6]([OH:7])=[O:8].[CH3:29][O-:30].[CH3:37][OH:38].[F:9][C:10]([CH2:11][N:12]=[C:13]([NH:14][c:15]1[n:16][c:17]([S:21][CH2:22][CH2:23][CH2:24][SH:25])[n:18][cH:19][cH:20]1)[NH2:26])([F:27])[F:28].[I:32][CH2:33][C:34](=[O:35])[NH2:36].[Na+:31]>>[F:9][C:10]([CH2:11][N:12]=[C:13]([NH:14][c:15]1[n:16][c:17]([S:21][CH2:22][CH2:23][CH2:24][S:25][CH2:33][C:34](=[O:35])[NH2:36])[n:18][cH:19][cH:20]1)[NH2:26])([F:27])[F:28]Participants
7
Sources & evidence
- ORD record
- ord-56dbec398c9849af8d7e029f73b0110a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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