Ethanol → HCID 25133043, compound

HRID 1113676Notes

Reaction equation

HRID 1113676 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[nH:7][c:8]([CH3:32])[c:9]([C:12]([C:13]([N:14]2[CH2:15][CH2:16][N:17]([c:20]3[cH:21][c:22]([C:26]([F:27])([F:28])[F:29])[cH:23][cH:24][cH:25]3)[CH2:18][CH2:19]2)=[O:30])=[O:31])[c:10]1[CH3:11].[CH3:34][CH2:35][OH:36].[OH2:33]>>[O:3]=[C:4]([OH:5])[c:6]1[nH:7][c:8]([CH3:32])[c:9]([C:12]([C:13]([N:14]2[CH2:15][CH2:16][N:17]([c:20]3[cH:21][c:22]([C:26]([F:27])([F:28])[F:29])[cH:23][cH:24][cH:25]3)[CH2:18][CH2:19]2)=[O:30])=[O:31])[c:10]1[CH3:11]

Participants

4

Sources & evidence

ORD record
ord-7d1d554542334d94b270273f2f46fe6f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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