Ethanol → HCID 22989421, compound

HRID 675463Notes

Reaction equation

HRID 675463 reaction equation
[CH3:43][CH2:44][OH:45].[Na+:42].[OH-:41].[c:1]1([CH:7]([N:8]2[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][CH2:16][CH2:17][c:18]3[cH:19][cH:20][c:21]4[n:22]([n:23]3)[cH:24][c:25]([C:27]([C:28](=[O:29])[O:30][CH2:31][CH3:32])([CH3:33])[CH3:34])[n:26]4)[CH2:12][CH2:13]2)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([N:8]2[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][CH2:16][CH2:17][c:18]3[cH:19][cH:20][c:21]4[n:22]([n:23]3)[cH:24][c:25]([C:27]([C:28](=[O:29])[OH:30])([CH3:33])[CH3:34])[n:26]4)[CH2:12][CH2:13]2)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 22989260HCID 22989260, compound

Product 1

HCID 22989421HCID 22989421, compound

Sources & evidence

ORD record
ord-64476f57d6fd4bd6a0186c7e208e3f7c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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