Ethanol → HCID 12992512, compound

HRID 1566478Notes

Reaction equation

HRID 1566478 reaction equation
[CH3:40][CH2:41][OH:42].[Na+:39].[OH-:38].[OH:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:21]([c:22]3[cH:23][cH:24][c:25]([O:28][CH2:29][CH2:30][N:31]4[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]4)[cH:26][cH:27]3)=[O:37])[c:10]3[c:11]([s:12]2)[cH:13][c:14]([NH:17][C:18](=[O:19])[CH3:20])[cH:15][cH:16]3)[cH:6][cH:7]1>>[OH:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:21]([c:22]3[cH:23][cH:24][c:25]([O:28][CH2:29][CH2:30][N:31]4[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]4)[cH:26][cH:27]3)=[O:37])[c:10]3[c:11]([s:12]2)[cH:13][c:14]([NH2:17])[cH:15][cH:16]3)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 12992511HCID 12992511, compound

Product 1

HCID 12992512HCID 12992512, compound

Sources & evidence

ORD record
ord-66254f87015948748c69ec50d83e7181
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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