Methanol → [4-(8-Ethyl-2,2,4,4-tetramethyl-chroman-6-yl-ethynyl) phenyl]acetic acid
Reaction equation
[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][c:15]3[c:20]([c:21]([CH2:23][CH3:24])[cH:22]2)[O:19][C:18]([CH3:25])([CH3:26])[CH2:17][C:16]3([CH3:27])[CH3:28])[cH:9][cH:10]1)=[O:29].[CH3:30][OH:31].[CH3:35][C:36]#[N:37].[Na+:33].[OH-:32].[OH2:34]>>[O:2]=[C:3]([CH2:4][c:5]1[cH:6][cH:7][c:8]([C:11]#[C:12][c:13]2[cH:14][c:15]3[c:20]([c:21]([CH2:23][CH3:24])[cH:22]2)[O:19][C:18]([CH3:25])([CH3:26])[CH2:17][C:16]3([CH3:27])[CH3:28])[cH:9][cH:10]1)[OH:29]Participants
7
Sources & evidence
- ORD record
- ord-e6e2b4a464fe46eb9624e9374bb448ee
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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