Ethanol → HCID 77255180, compound

HRID 175936Notes

Reaction equation

HRID 175936 reaction equation
[CH3:38][CH2:39][OH:40].[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH:12]2[CH2:13][N:14]([c:17]3[c:18]([CH:27]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[CH2:33][CH2:34][CH3:35])[c:19]([CH3:26])[n:20][c:21]4[n:22]3[n:23][cH:24][cH:25]4)[CH2:15][CH2:16]2)[cH:6][cH:7]1.[Na+:37].[OH-:36]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[NH:11][CH:12]2[CH2:13][N:14]([c:17]3[c:18]([CH:27]([C:28](=[O:29])[OH:30])[CH2:33][CH2:34][CH3:35])[c:19]([CH3:26])[n:20][c:21]4[n:22]3[n:23][cH:24][cH:25]4)[CH2:15][CH2:16]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 77255064HCID 77255064, compound

Product 1

HCID 77255180HCID 77255180, compound

Sources & evidence

ORD record
ord-4b3d20821b3c438cb73f22e54c83585f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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