Ethanol → HCID 10319998, compound

HRID 687990Notes

Reaction equation

HRID 687990 reaction equation
[CH3:39][CH2:40][OH:41].[F:1][c:2]1[c:3](-[n:9]2[cH:10][c:11]([C:34](=[O:35])[OH:36])[c:12](=[O:33])[c:13]3[cH:14][c:15]([F:32])[c:16]([N:20]4[CH2:21][C:22]([NH:24][C:25](=[O:26])[C:27]([F:28])([F:29])[F:30])([CH3:31])[CH2:23]4)[c:17]([F:19])[c:18]23)[cH:4][cH:5][c:6]([F:8])[cH:7]1.[Na+:38].[OH-:37].[OH2:42]>>[F:1][c:2]1[c:3](-[n:9]2[cH:10][c:11]([C:34](=[O:35])[OH:36])[c:12](=[O:33])[c:13]3[cH:14][c:15]([F:32])[c:16]([N:20]4[CH2:21][C:22]([NH2:24])([CH3:31])[CH2:23]4)[c:17]([F:19])[c:18]23)[cH:4][cH:5][c:6]([F:8])[cH:7]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 10459230HCID 10459230, compound

Product 1

HCID 10319998HCID 10319998, compound

Sources & evidence

ORD record
ord-858ddd9ee6c146d8bec8c995497f7c09
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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