Acetic Acid → HCID 68781049, compound

HRID 2133184Notes

Reaction equation

HRID 2133184 reaction equation
[C:33]([BH3-:34])#[N:35].[CH2:16]([CH3:17])[O:18][c:19]1[cH:20][c:21]([CH:22]=[O:23])[cH:24][cH:25][c:26]1[O:27][CH3:28].[CH2:1]([CH3:2])[c:3]1[cH:4][n:5][c:6]([NH:9][CH:10]2[CH2:11][CH2:12][NH:13][CH2:14][CH2:15]2)[n:7][cH:8]1.[CH3:29][C:30](=[O:31])[OH:32].[CH3:37][CH2:38][OH:39].[Na+:36]>>[CH2:1]([CH3:2])[c:3]1[cH:4][n:5][c:6]([NH:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:22][c:21]3[cH:20][c:19]([O:18][CH2:16][CH3:17])[c:26]([O:27][CH3:28])[cH:25][cH:24]3)[CH2:14][CH2:15]2)[n:7][cH:8]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 702EthanolHCID 923Sodium ionHCID 2447283-Ethoxy-4-methoxybenzaldehydeHCID 498716Cyano-borohydrideHCID 58972434HCID 58972434, compound

Product 1

HCID 68781049HCID 68781049, compound

Sources & evidence

ORD record
ord-f7a68d6d54074df08f3cfb414619f36e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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