Acetic Acid → HCID 17981674, compound

HRID 1231397Notes

Reaction equation

HRID 1231397 reaction equation
[C:40]([BH3-:41])#[N:42].[CH2:1]=[O:2].[CH3:36][C:37](=[O:38])[OH:39].[CH3:44][OH:45].[CH:3]([CH3:4])([CH3:5])[S:6](=[O:7])(=[O:8])[n:9]1[c:10]([NH2:35])[n:11][c:12]2[c:13]1[cH:14][c:15](-[c:18]1[c:19](-[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[n:20][cH:21][n:22]1[CH:23]1[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]1)[cH:16][cH:17]2.[Na+:43]>>[CH:3]([CH3:4])([CH3:5])[S:6](=[O:7])(=[O:8])[n:9]1[c:10]([NH2:35])[n:11][c:12]2[c:13]1[cH:14][c:15](-[c:18]1[c:19](-[c:29]3[cH:30][cH:31][cH:32][cH:33][cH:34]3)[n:20][cH:21][n:22]1[CH:23]1[CH2:24][CH2:25][N:26]([CH3:36])[CH2:27][CH2:28]1)[cH:16][cH:17]2

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 712FormaldehydeHCID 887MethanolHCID 923Sodium ionHCID 498716Cyano-borohydrideHCID 17981877HCID 17981877, compound

Product 1

HCID 17981674HCID 17981674, compound

Sources & evidence

ORD record
ord-a772f92d6a7d41209175215042e93dd5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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