Acetic Acid → HCID 11677629, compound

HRID 681715Notes

Reaction equation

HRID 681715 reaction equation
[C:30]([BH3-:31])#[N:32].[CH2:1]([CH3:2])[N:3]([CH2:4][CH2:5][CH2:6][CH2:7][N:8]([CH2:9][CH2:10][CH3:11])[CH2:12][CH2:13][CH3:14])[CH2:15][c:16]1[cH:17][cH:18][c:19]([CH2:22][NH:23][CH2:24][c:25]2[nH:26][cH:27][cH:28][n:29]2)[cH:20][cH:21]1.[CH3:34][C:35](=[O:36])[OH:37].[CH3:38][n:39]1[c:40]([CH:44]=[O:45])[n:41][cH:42][cH:43]1.[CH3:46][OH:47].[Na+:33]>>[CH2:1]([CH3:2])[N:3]([CH2:4][CH2:5][CH2:6][CH2:7][N:8]([CH2:9][CH2:10][CH3:11])[CH2:12][CH2:13][CH3:14])[CH2:15][c:16]1[cH:17][cH:18][c:19]([CH2:22][N:23]([CH2:24][c:25]2[n:26][cH:27][cH:28][nH:29]2)[CH2:44][c:40]2[n:39]([CH3:38])[cH:43][cH:42][n:41]2)[cH:20][cH:21]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 1395751-Methyl-2-imidazolecarboxaldehydeHCID 498716Cyano-borohydrideHCID 23155374HCID 23155374, compound

Product 1

HCID 11677629HCID 11677629, compound

Sources & evidence

ORD record
ord-9f988dfd1dba4197bff7a344f1539d87
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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