Ethanol → HCID 18188090, compound

HRID 1225204Notes

Reaction equation

HRID 1225204 reaction equation
[CH3:41][CH2:42][OH:43].[Na+:40].[OH-:39].[OH2:44].[OH:1][CH2:2][CH2:3][CH2:4][CH:5]([CH2:6][C:7](=[O:8])[O:9][CH2:10][CH3:11])[c:12]1[cH:13][cH:14][c:15]([NH:18][C:19]([CH2:20][c:21]2[cH:22][c:23]3[c:24]([n:25][c:26]([NH:28][c:29]4[c:30]([CH3:35])[cH:31][cH:32][cH:33][cH:34]4)[o:27]3)[cH:36][cH:37]2)=[O:38])[cH:16][cH:17]1>>[OH:1][CH2:2][CH2:3][CH2:4][CH:5]([CH2:6][C:7](=[O:8])[OH:9])[c:12]1[cH:13][cH:14][c:15]([NH:18][C:19]([CH2:20][c:21]2[cH:22][c:23]3[c:24]([n:25][c:26]([NH:28][c:29]4[c:30]([CH3:35])[cH:31][cH:32][cH:33][cH:34]4)[o:27]3)[cH:36][cH:37]2)=[O:38])[cH:16][cH:17]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 18188111HCID 18188111, compound

Product 1

HCID 18188090HCID 18188090, compound

Sources & evidence

ORD record
ord-09a1797088744f8c83efcfa417add063
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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