Hydrochloric Acid → 4-(3-Cyclopentyloxy-4-methoxyphenyl)-4-(3-carbomethoxyphenylethynyl)cyclohexan-1-one
Reaction equation
[CH:1]1([O:6][c:7]2[cH:8][c:9]([C:15]3([C:25]#[C:26][c:27]4[cH:28][c:29]([C:33](=[O:34])[O:35][CH3:36])[cH:30][cH:31][cH:32]4)[CH2:16][CH2:17][C:18]4([CH2:19][CH2:20]3)[O:21][CH2:24][CH2:23][O:22]4)[cH:10][cH:11][c:12]2[O:13][CH3:14])[CH2:2][CH2:3][CH2:4][CH2:5]1.[ClH:37].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH2:38]>>[CH:1]1([O:6][c:7]2[cH:8][c:9]([C:15]3([C:25]#[C:26][c:27]4[cH:28][c:29]([C:33](=[O:34])[O:35][CH3:36])[cH:30][cH:31][cH:32]4)[CH2:16][CH2:17][C:18](=[O:21])[CH2:19][CH2:20]3)[cH:10][cH:11][c:12]2[O:13][CH3:14])[CH2:2][CH2:3][CH2:4][CH2:5]1Participants
5
Sources & evidence
- ORD record
- ord-4e6a0567578e43faa08d30139bd42b36
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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