Ethanol → HCID 59356008, compound

HRID 2139343Notes

Reaction equation

HRID 2139343 reaction equation
[CH3:1][O:2][C:3]([CH2:4][CH2:5][NH:6][C:7](=[O:8])[c:9]1[s:10][c:11]([C:14]2([CH2:19][O:20][c:21]3[cH:22][c:23]([CH3:38])[c:24](-[c:28]4[cH:29][cH:30][c:31]([C:34]([F:35])([F:36])[F:37])[cH:32][cH:33]4)[c:25]([CH3:27])[cH:26]3)[CH2:15][CH:16]=[CH:17][CH2:18]2)[cH:12][cH:13]1)=[O:39].[CH3:40][CH2:41][OH:42]>>[CH3:1][O:2][C:3]([CH2:4][CH2:5][NH:6][C:7](=[O:8])[c:9]1[s:10][c:11]([C:14]2([CH2:19][O:20][c:21]3[cH:22][c:23]([CH3:38])[c:24](-[c:28]4[cH:29][cH:30][c:31]([C:34]([F:35])([F:36])[F:37])[cH:32][cH:33]4)[c:25]([CH3:27])[cH:26]3)[CH2:15][CH2:16][CH2:17][CH2:18]2)[cH:12][cH:13]1)=[O:39]

Participants

3

Sources & evidence

ORD record
ord-c34f5b2cc51942b1bfc9abad4cfdf8c3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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