Bicarbonate Ion → HCID 178475619, compound
Reaction equation
[CH3:18][O:19][C:20]([CH3:21])([O:22][CH3:23])[O:24][CH3:25].[CH3:1][c:2]1[cH:3][cH:4][c:5]([S:6]([OH:7])(=[O:8])=[O:9])[cH:10][cH:11]1.[CH3:62][c:63]1[cH:64][cH:65][c:66]([S:67]([OH:68])(=[O:69])=[O:70])[cH:71][cH:72]1.[CH3:82][CH2:83][O:84][C:85]([CH3:86])=[O:87].[Cl:78][CH2:79][Cl:80].[F:26][c:27]1[cH:28][cH:29][c:30](-[n:33]2[n:34][cH:35][c:36]3[c:41]2[CH:40]=[C:39]2[C:38]([CH3:60])([CH2:37]3)[CH:49]3[CH:44]([CH2:43][CH2:42]2)[CH:45]2[C:46]([CH3:59])([CH2:47][CH:48]3[OH:50])[C:51]([OH:54])([C:55]([CH2:56][OH:57])=[O:58])[CH2:52][CH2:53]2)[cH:31][cH:32]1.[Na+:77].[O-:73][C:74]([OH:75])=[O:76].[OH2:61].[OH2:81].[n:12]1[cH:13][cH:14][cH:15][cH:16][cH:17]1>>[O:19]=[C:20]([CH3:21])[O:54][C:51]1([C:55]([CH2:56][OH:57])=[O:58])[C:46]2([CH3:59])[CH:45]([CH:44]3[CH2:43][CH2:42][C:39]4=[CH:40][c:41]5[n:33](-[c:30]6[cH:29][cH:28][c:27]([F:26])[cH:32][cH:31]6)[n:34][cH:35][c:36]5[CH2:37][C:38]4([CH3:60])[CH:49]3[CH:48]([OH:50])[CH2:47]2)[CH2:53][CH2:52]1Participants
10
Sources & evidence
- ORD record
- ord-6d706aa5191f443dbf8ce9af394d468f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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