(2-(trifluoromethyl)phenyl)acetic acid → HCID 11669804, 화합물
반응식
[CH:15]1([CH2:18][CH2:19][NH:20][C:21](=[O:22])[c:23]2[n:24][n:25][c:26]([N:29]3[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]3)[cH:27][cH:28]2)[CH2:16][CH2:17]1.[F:1][C:2]([c:3]1[c:4]([CH2:9][C:10](=[O:11])[OH:12])[cH:5][cH:6][cH:7][cH:8]1)([F:13])[F:14]>>[F:1][C:2]([c:3]1[c:4]([CH2:9][C:10](=[O:12])[N:32]2[CH2:31][CH2:30][N:29]([c:26]3[n:25][n:24][c:23]([C:21]([NH:20][CH2:19][CH2:18][CH:15]4[CH2:16][CH2:17]4)=[O:22])[cH:28][cH:27]3)[CH2:34][CH2:33]2)[cH:5][cH:6][cH:7][cH:8]1)([F:13])[F:14]참가 물질
3
출처 및 근거
- ORD 기록
- ord-80d70210314442d6b5e3220551a4b023
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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