Acetic Acid → HCID 21477679, compound

HRID 306460Notes

Reaction equation

HRID 306460 reaction equation
[C:37]([BH3-:38])#[N:39].[CH3:41][C:42]([CH3:43])=[O:44].[CH3:47][OH:48].[CH3:49][C:50](=[O:51])[OH:52].[N:1]1([C:7](=[O:8])[NH:9][c:10]2[cH:11][c:12]3[cH:13][c:14]([C:19](=[O:20])[N:21]4[CH2:22][CH2:23][N:24]([c:27]5[n:28][cH:29][cH:30][cH:31][c:32]5[NH:33][CH:34]([CH3:35])[CH3:36])[CH2:25][CH2:26]4)[nH:15][c:16]3[cH:17][cH:18]2)[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[Na+:40].[Na+:46].[OH-:45]>>[N:1]1([C:7](=[O:8])[NH:9][c:10]2[cH:11][c:12]3[cH:13][c:14]([C:19](=[O:20])[N:21]4[CH2:22][CH2:23][N:24]([c:27]5[n:28][cH:29][cH:30][cH:31][c:32]5[NH:33][CH:34]([CH3:35])[CH3:36])[CH2:25][CH2:26]4)[nH:15][c:16]3[cH:17][cH:18]2)[CH2:2][CH2:3][N:4]([CH:42]([CH3:41])[CH3:43])[CH2:5][CH2:6]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 180AcetoneHCID 887MethanolHCID 923Sodium ion2×HCID 961HydroxideHCID 498716Cyano-borohydrideHCID 21477598HCID 21477598, compound

Product 1

HCID 21477679HCID 21477679, compound

Sources & evidence

ORD record
ord-5bcebad0018d4329971d6d385a4cdf62
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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