Bicarbonate Ion → HCID 178446804, compound
Reaction equation
[C:94](=[O:95])([OH:96])[O-:97].[CH3:103][CH2:104][O:105][C:106](=[O:107])[CH3:108].[CH:99]([Cl:100])([Cl:101])[Cl:102].[Na+:92].[Na+:93].[Na+:98].[OH:1][CH:2]([CH2:3][NH:4][S:5](=[O:6])(=[O:7])[c:8]1[n:9][cH:10][cH:11][cH:12][cH:13]1)[CH:14]([CH2:15][CH2:16][CH2:17][CH3:18])[NH:19][C:20]([O:21][CH:22]([C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:27][n:28]1[cH:29][n:30][c:31](-[c:33]2[cH:34][cH:35][c:36]([C:39]([F:40])([F:41])[F:42])[cH:37][cH:38]2)[cH:32]1)=[O:43].[OH:44][CH:45]([CH:46]([NH:47][C:48](=[O:49])[O:50][CH:51]([CH2:52][n:53]1[cH:54][c:55](-[c:56]2[cH:57][cH:58][c:59]([C:60]([F:61])([F:62])[F:63])[cH:64][cH:65]2)[n:66][cH:67]1)[C:68]([CH3:69])([CH3:70])[CH3:71])[CH2:72][CH2:73][CH2:74][CH3:75])[CH2:76][NH:77][S:78]([c:79]1[cH:80][cH:81][cH:82][cH:83][n:84]1)(=[O:85])=[O:86].[S:87]([O-:88])([O-:89])(=[O:90])=[S:91]>>[O:1]=[C:2]([CH2:3][NH:4][S:5](=[O:6])(=[O:7])[c:8]1[n:9][cH:10][cH:11][cH:12][cH:13]1)[CH:14]([CH2:15][CH2:16][CH2:17][CH3:18])[NH:19][C:20]([O:21][CH:22]([C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:27][n:28]1[cH:29][n:30][c:31](-[c:33]2[cH:34][cH:35][c:36]([C:39]([F:40])([F:41])[F:42])[cH:37][cH:38]2)[cH:32]1)=[O:43]Participants
7
Sources & evidence
- ORD record
- ord-45129ec955694feaa5fc72e6e1c43ab6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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