Acetic Acid → HCID 46198655, compound

HRID 1565354Notes

Reaction equation

HRID 1565354 reaction equation
[C:40]([BH3-:41])#[N:42].[CH2:38]=[O:39].[CH3:1][n:2]1[n:3][cH:4][c:5](-[c:7]2[cH:8][cH:9][c:10]([NH:13][c:14]3[n:15][c:16]([N:24]([CH2:25][CH2:26][OH:27])[c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:17]4[c:18]([n:19]3)[CH2:20][CH2:21][NH:22][CH2:23]4)[cH:11][cH:12]2)[cH:6]1.[CH3:34][C:35](=[O:36])[OH:37].[CH3:44][OH:45].[Na+:43]>>[CH3:1][n:2]1[n:3][cH:4][c:5](-[c:7]2[cH:8][cH:9][c:10]([NH:13][c:14]3[n:15][c:16]([N:24]([CH2:25][CH2:26][OH:27])[c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[c:17]4[c:18]([n:19]3)[CH2:20][CH2:21][N:22]([CH3:34])[CH2:23]4)[cH:11][cH:12]2)[cH:6]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 712FormaldehydeHCID 887MethanolHCID 923Sodium ionHCID 498716Cyano-borohydrideHCID 59333755HCID 59333755, compound

Product 1

HCID 46198655HCID 46198655, compound

Sources & evidence

ORD record
ord-6a8447f7d9b9495f8e74a6d4c96a2ce0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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