Bicarbonate Ion → HCID 91237799, compound
Reaction equation
[C:57](=[O:58])([OH:59])[O-:60].[CH3:62][CH2:63][O:64][C:65](=[O:66])[CH3:67].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][c:11]([N:14]3[CH2:15][CH2:16][O:17][CH2:18][CH2:19]3)[cH:12][n:13]2)[CH2:20][c:21]2[c:22]([N:31]([C:32]([NH:33][CH:34]([C:35](=[O:36])[O:37][CH3:38])[CH2:39][O:40][C:41]([CH3:42])([CH3:43])[CH3:44])=[O:45])[CH2:46][CH3:47])[cH:23][cH:24][c:25]([C:27]([F:28])([F:29])[F:30])[cH:26]2)[cH:48][c:49]([C:51]([F:52])([F:53])[F:54])[cH:50]1)([F:55])[F:56].[Na+:61].[O:68]1[CH2:69][CH2:70][O:71][CH2:72][CH2:73]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]([c:8]2[n:9][cH:10][c:11]([N:14]3[CH2:15][CH2:16][O:17][CH2:18][CH2:19]3)[cH:12][n:13]2)[CH2:20][c:21]2[c:22]([N:31]([C:32]([NH:33][CH:34]([C:35](=[O:36])[O:37][CH3:38])[CH2:39][OH:40])=[O:45])[CH2:46][CH3:47])[cH:23][cH:24][c:25]([C:27]([F:28])([F:29])[F:30])[cH:26]2)[cH:48][c:49]([C:51]([F:52])([F:53])[F:54])[cH:50]1)([F:55])[F:56]Participants
6
Sources & evidence
- ORD record
- ord-0aaf5bdf886a4ef4bcb882699d9dd00d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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