5-Isocyanato-1,3-dioxaindane → 1-[6-(3,4-Methylenedioxyphenylcarbamoyloxy)hexyl]-4-(6-fluoro-1,2-benzisoxazol-3-yl) piperidine
반응식
[CH2:24]1[O:25][c:26]2[cH:27][c:28]([N:33]=[C:34]=[O:35])[cH:29][cH:30][c:31]2[O:32]1.[OH:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[n:15][o:16][c:17]3[c:18]2[cH:19][cH:20][c:21]([F:23])[cH:22]3)[CH2:12][CH2:13]1>>[O:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[n:15][o:16][c:17]3[c:18]2[cH:19][cH:20][c:21]([F:23])[cH:22]3)[CH2:12][CH2:13]1)[C:34]([NH:33][c:28]1[cH:27][c:26]2[c:31]([cH:30][cH:29]1)[O:32][CH2:24][O:25]2)=[O:35]참가 물질
3
출처 및 근거
- ORD 기록
- ord-659b23780a2f45369fb303724203e777
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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