Bicarbonate Ion → HCID 178448495, compound

HRID 205474Notes

Reaction equation

HRID 205474 reaction equation
[C:50](=[O:51])([O-:52])[OH:53].[C:6]([O:7][BH-:8]([O:9][C:10](=[O:11])[CH3:12])[O:13][C:14](=[O:15])[CH3:16])(=[O:17])[CH3:18].[CH:1]([CH:2]([CH3:3])[CH3:4])=[O:5].[Cl:20][c:21]1[cH:22][cH:23][c:24]([CH:27]([N:28]2[CH2:29][CH:30]([N:32]([SH:33](=[O:34])=[O:35])[CH2:36][CH:37]3[CH2:38][CH2:39][NH:40][CH2:41][CH2:42]3)[CH2:31]2)[c:43]2[cH:44][cH:45][c:46]([Cl:49])[cH:47][cH:48]2)[cH:25][cH:26]1.[Cl:55][CH2:56][Cl:57].[Na+:19].[Na+:54]>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[N:40]1[CH2:39][CH2:38][CH:37]([CH2:36][N:32]([CH:30]2[CH2:29][N:28]([CH:27]([c:24]3[cH:23][cH:22][c:21]([Cl:20])[cH:26][cH:25]3)[c:43]3[cH:44][cH:45][c:46]([Cl:49])[cH:47][cH:48]3)[CH2:31]2)[SH:33](=[O:34])=[O:35])[CH2:42][CH2:41]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 6344DichloromethaneHCID 6561IsobutyraldehydeHCID 2724942TriacetoxyborohydrideHCID 178527244HCID 178527244, compound

Product 1

HCID 178448495HCID 178448495, compound

Sources & evidence

ORD record
ord-9b1f330d5cab40b08112b9a0edb4dabb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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