Bicarbonate Ion → HCID 22054150, compound

HRID 679791Notes

Reaction equation

HRID 679791 reaction equation
[CH3:45][OH:46].[Na+:40].[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][cH:9][c:10]([NH:13][C:14]([c:15]3[c:16]([O:35][C:36](=[O:37])[CH3:38])[cH:17][cH:18][c:19]([CH2:21][C:22]4=[C:27]([CH3:28])[C:26](=[O:29])[C:25]([O:30][CH3:31])=[C:24]([O:32][CH3:33])[C:23]4=[O:34])[cH:20]3)=[O:39])[cH:11][n:12]2)[CH2:5][CH2:6]1.[OH2:47].[OH:41][C:42](=[O:43])[O-:44]>>[O:1]1[CH2:2][CH2:3][N:4]([c:7]2[cH:8][cH:9][c:10]([NH:13][C:14]([c:15]3[c:16]([OH:35])[cH:17][cH:18][c:19]([CH2:21][C:22]4=[C:27]([CH3:28])[C:26](=[O:29])[C:25]([O:30][CH3:31])=[C:24]([O:32][CH3:33])[C:23]4=[O:34])[cH:20]3)=[O:39])[cH:11][n:12]2)[CH2:5][CH2:6]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium ionHCID 962WaterHCID 22054163HCID 22054163, compound

Product 1

HCID 22054150HCID 22054150, compound

Sources & evidence

ORD record
ord-c6def499419141df98656dc2c86f9915
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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