Acetic Acid → 6-(3-Acetoxy-propoxy)-7-methoxy-1-(3-methoxy-benzoyl)-isoquinoline-4-carbaldehyde
Reaction equation
[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][c:11]2[c:12]([CH:30]=[O:31])[cH:13][n:14][c:15]([CH2:21][c:22]3[cH:23][c:24]([O:28][CH3:29])[cH:25][cH:26][cH:27]3)[c:16]2[cH:17][c:18]1[O:19][CH3:20].[C:41]([O:42][CH2:43][CH3:44])(=[O:45])[CH3:46].[CH3:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40].[CH3:47][C:48](=[O:49])[OH:50].[Se:32](=[O:33])=[O:34]>>[C:1]([CH3:2])(=[O:3])[O:4][CH2:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][c:11]2[c:12]([CH:30]=[O:31])[cH:13][n:14][c:15]([C:21]([c:22]3[cH:23][c:24]([O:28][CH3:29])[cH:25][cH:26][cH:27]3)=[O:33])[c:16]2[cH:17][c:18]1[O:19][CH3:20]Participants
6
Sources & evidence
- ORD record
- ord-5b17a0771e6046e782220a44bbbff87c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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