Methanol → [4-(8-Cyclopropyl-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]([CH:23]4[CH2:24][CH2:25]4)[cH:22]2)[O:19][C:18]([CH3:26])([CH3:27])[CH2:17][C:16]3([CH3:28])[CH3:29])[cH:9][cH:10]1)=[O:30].[CH3:31][OH:32].[CH3:36][C:37]#[N:38].[Na+:34].[OH-:33].[OH2:35]>>[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]([CH:23]4[CH2:24][CH2:25]4)[cH:22]2)[O:19][C:18]([CH3:26])([CH3:27])[CH2:17][C:16]3([CH3:28])[CH3:29])[cH:9][cH:10]1)[OH:30]Participants
7
Sources & evidence
- ORD record
- ord-ba59d5bd066a4b868c8b245416c37ec6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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