Acetic Acid → HCID 54451745, compound

HRID 1200531Notes

Reaction equation

HRID 1200531 reaction equation
[C:36]([BH3-:37])#[N:38].[CH2:1]1[O:2][c:3]2[cH:4][c:5]([CH:10]3[N:11]([C:23]([CH:24]=[CH:25][c:26]4[cH:27][cH:28][c:29]([CH:32]=[N:33][CH3:34])[cH:30][cH:31]4)=[O:35])[CH2:12][CH2:13][c:14]4[c:15]5[cH:16][cH:17][cH:18][cH:19][c:20]5[nH:21][c:22]43)[cH:6][cH:7][c:8]2[O:9]1.[CH3:40][C:41](=[O:42])[OH:43].[CH3:44][OH:45].[Na+:39]>>[CH2:1]1[O:2][c:3]2[cH:4][c:5]([CH:10]3[N:11]([C:23]([CH:24]=[CH:25][c:26]4[cH:27][cH:28][c:29]([CH2:32][NH:33][CH3:34])[cH:30][cH:31]4)=[O:35])[CH2:12][CH2:13][c:14]4[c:15]5[cH:16][cH:17][cH:18][cH:19][c:20]5[nH:21][c:22]43)[cH:6][cH:7][c:8]2[O:9]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 498716Cyano-borohydrideHCID 53818825HCID 53818825, compound

Product 1

HCID 54451745HCID 54451745, compound

Sources & evidence

ORD record
ord-3954b92754c24234bf771d3fb0000f03
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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