2-(Isoquinolin-5-YL)acetic acid → HCID 52944909, 화합물
반응식
[NH2:1][c:2]1[c:3]([C:7](=[O:8])[O:9][CH3:10])[n:4][cH:5][s:6]1.[cH:11]1[n:12][cH:13][cH:14][c:15]2[c:16]([CH2:21][C:22](=[O:23])[OH:24])[cH:17][cH:18][cH:19][c:20]12>>[NH:1]([c:2]1[c:3]([C:7](=[O:8])[O:9][CH3:10])[n:4][cH:5][s:6]1)[C:22]([CH2:21][c:16]1[c:15]2[cH:14][cH:13][n:12][cH:11][c:20]2[cH:19][cH:18][cH:17]1)=[O:23]참가 물질
3
출처 및 근거
- ORD 기록
- ord-0a2d0ef721214316b3ad0b7f1128ef1b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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