2-(Isoquinolin-5-YL)acetic acid → HCID 46868997, compound
Reaction equation
[CH3:15][c:16]1[cH:17][n:18][c:19](-[c:21]2[s:22][cH:23][cH:24][c:25]2[NH2:26])[s:20]1.[cH:1]1[n:2][cH:3][cH:4][c:5]2[c:6]([CH2:11][C:12](=[O:13])[OH:14])[cH:7][cH:8][cH:9][c:10]12>>[cH:1]1[n:2][cH:3][cH:4][c:5]2[c:6]([CH2:11][C:12](=[O:14])[NH:26][c:25]3[c:21](-[c:19]4[n:18][cH:17][c:16]([CH3:15])[s:20]4)[s:22][cH:23][cH:24]3)[cH:7][cH:8][cH:9][c:10]12Participants
3
Sources & evidence
- ORD record
- ord-d9a191cbb4c7481ca56cd1017fdd0366
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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