Acetic Acid → HCID 68494343, compound

HRID 163330Notes

Reaction equation

HRID 163330 reaction equation
[C:1]([OH:2])(=[O:3])[CH3:4].[CH2:5]([CH3:6])[O:7][C:8]1=[C:9]([O:31][CH2:32][c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[CH2:10][CH:11]2[CH2:12][CH2:13][N:14]([CH2:18][c:19]3[cH:20][c:21]([O:29][CH3:30])[c:22]([O:27][CH3:28])[c:23]([O:25][CH3:26])[cH:24]3)[CH2:15][C:16]2=[CH:17]1.[CH3:39][CH2:40][OH:41]>>[CH2:5]([CH3:6])[O:7][C:8]1=[C:9]([OH:31])[CH2:10][CH:11]2[CH2:12][CH2:13][N:14]([CH2:18][c:19]3[cH:20][c:21]([O:29][CH3:30])[c:22]([O:27][CH3:28])[c:23]([O:25][CH3:26])[cH:24]3)[CH2:15][C:16]2=[CH:17]1

Participants

4

Sources & evidence

ORD record
ord-ecfdfca3309947aa9983df1294082d29
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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