Bicarbonate Ion → HCID 23069569, compound

HRID 165254Notes

Reaction equation

HRID 165254 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][CH:11]([CH2:14][O:15][c:16]2[c:17]([C:45]#[N:46])[cH:18][c:19]3[c:20]([O:26][c:27]4[cH:28][c:29]([F:44])[c:30]([NH:33][C:34](=[O:35])[NH:36][c:37]5[cH:38][cH:39][c:40]([F:43])[cH:41][cH:42]5)[cH:31][cH:32]4)[cH:21][cH:22][n:23][c:24]3[cH:25]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[C:48](=[O:49])([OH:50])[O-:51].[Na+:52].[OH2:47].[OH:53][C:54]([C:55]([F:56])([F:57])[F:58])=[O:59]>>[NH:8]1[CH2:9][CH2:10][CH:11]([CH2:14][O:15][c:16]2[c:17]([C:45]#[N:46])[cH:18][c:19]3[c:20]([O:26][c:27]4[cH:28][c:29]([F:44])[c:30]([NH:33][C:34](=[O:35])[NH:36][c:37]5[cH:38][cH:39][c:40]([F:43])[cH:41][cH:42]5)[cH:31][cH:32]4)[cH:21][cH:22][n:23][c:24]3[cH:25]2)[CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 6422Trifluoroacetic acidHCID 67203610HCID 67203610, compound

Product 1

HCID 23069569HCID 23069569, compound

Sources & evidence

ORD record
ord-8a5cf711935c4af7827da478eb83d96e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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