Acetic Acid → HCID 67284408, compound
Reaction equation
[C:37](=[O:38])([O-:39])[OH:40].[CH3:26][c:27]1[c:28]2[cH:29][cH:30][nH:31][c:32]2[cH:33][cH:34][cH:35]1.[CH3:42][C:43](=[O:44])[OH:45].[Na+:41].[OH2:36].[OH:1][CH2:2][c:3]1[c:4](-[c:12]2[c:13]([C:22](=[O:23])[O:24][CH3:25])[c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]3[cH:20][cH:21]2)[n:5][c:6]2[n:7]1[cH:8][cH:9][cH:10][cH:11]2>>[CH2:2]([c:3]1[c:4](-[c:12]2[c:13]([C:22](=[O:23])[O:24][CH3:25])[c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]3[cH:20][cH:21]2)[n:5][c:6]2[n:7]1[cH:8][cH:9][cH:10][cH:11]2)[c:29]1[c:28]2[c:27]([CH3:26])[cH:35][cH:34][cH:33][c:32]2[nH:31][cH:30]1Participants
7
Sources & evidence
- ORD record
- ord-59476b21a3fd4b01a2babfbd0045a06e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…