Guaiacol → 2-Methoxy-3-{3-[3-(2-methoxy-phenoxy)-propoxy]-phenyl}-propionic acid
Reaction equation
[CH3:1][O:2][CH:3]([C:4](=[O:5])[OH:6])[CH2:7][c:8]1[cH:9][c:10]([O:14][CH2:15][CH2:16][CH2:17][O:18][c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)[cH:11][cH:12][cH:13]1.[CH3:25][O:26][c:27]1[c:28]([OH:29])[cH:30][cH:31][cH:32][cH:33]1.[CH3:34][O:35][CH:36]([CH2:37][c:38]1[cH:39][cH:40][c:41]([O:42][CH2:43][CH2:44][CH2:45][O:46][c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[cH:53][cH:54]1)[C:55]([OH:56])=[O:57]>>[CH3:1][O:2][CH:3]([C:4](=[O:5])[OH:6])[CH2:7][c:8]1[cH:9][c:10]([O:14][CH2:15][CH2:16][CH2:17][O:18][c:19]2[c:20]([O:26][CH3:25])[cH:21][cH:22][cH:23][cH:24]2)[cH:11][cH:12][cH:13]1Participants
4
Sources & evidence
- ORD record
- ord-a42b48440a3e4700b5eb7785552877f3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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