Acetaldehyde → HCID 54121951, compound

HRID 290151Notes

Reaction equation

HRID 290151 reaction equation
[C:39]([BH3-:40])#[N:41].[CH:36]([CH3:37])=[O:38].[NH2:1][c:2]1[cH:3][c:4]([O:34][CH3:35])[c:5]([C:6](=[O:7])[NH:8][CH2:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][NH:21][CH2:22][c:23]3[cH:24][c:25]([Cl:30])[c:26]([Cl:29])[cH:27][cH:28]3)[CH2:14][CH2:15]2)[cH:31][c:32]1[Cl:33].[Na+:42]>>[NH2:1][c:2]1[cH:3][c:4]([O:34][CH3:35])[c:5]([C:6](=[O:7])[NH:8][CH2:9][CH:10]2[CH2:11][CH2:12][N:13]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][N:21]([CH2:22][c:23]3[cH:24][c:25]([Cl:30])[c:26]([Cl:29])[cH:27][cH:28]3)[CH2:36][CH3:37])[CH2:14][CH2:15]2)[cH:31][c:32]1[Cl:33]

Participants

5

Reactant 4

HCID 177AcetaldehydeHCID 923Sodium ionHCID 498716Cyano-borohydrideHCID 54300629HCID 54300629, compound

Product 1

HCID 54121951HCID 54121951, compound

Sources & evidence

ORD record
ord-9a054a7e915b42d9aa5d8be5853ce757
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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