Ethanol → HCID 16040641, compound

HRID 2335906Notes

Reaction equation

HRID 2335906 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][N:18]([C:19](=[O:20])[c:21]3[s:22][c:23]4[c:24]([cH:25]3)[cH:26][cH:27][cH:28][cH:29]4)[c:30]3[cH:31][c:32]4[c:33]([cH:41][cH:42]3)[O:34][C:35]([CH3:39])([CH3:40])[O:36][C:37]4=[O:38])[cH:43][cH:44]2)[cH:9][cH:10]1.[CH3:47][CH2:48][OH:49].[Na+:46].[OH-:45]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][cH:15][c:16]([CH2:17][N:18]([C:19](=[O:20])[c:21]3[s:22][c:23]4[c:24]([cH:25]3)[cH:26][cH:27][cH:28][cH:29]4)[c:30]3[cH:31][c:32]([C:37](=[O:36])[OH:38])[c:33]([OH:34])[cH:41][cH:42]3)[cH:43][cH:44]2)[cH:9][cH:10]1

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 57841380HCID 57841380, compound

Product 1

HCID 16040641HCID 16040641, compound

Sources & evidence

ORD record
ord-7a1c0aae7bc84a67892d3197a1d3b975
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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