Methanol → 4-(8-Cyclopropyl-2,2,4,4-tetramethyl-chroman-6-yl-ethvnyl)-benzoic acid
Reaction equation
[CH2:1]([CH3:2])[O:3][C: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:3]=[C: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-9856ccf2aad64a63b67ed5b0bb522bd8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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