Ethanol → 8-[2-(6-Methoxy-[1,5]naphthyridin-4-yl)ethyl]-1,4-dioxa-spiro[4.5]decan-8-ol
반응식
[CH3:1][O:2][c:3]1[n:4][c:5]2[c:6]([C:13]#[C:14][C:15]3([OH:25])[CH2:16][CH2:17][C:18]4([O:19][CH2:20][CH2:21][O:22]4)[CH2:23][CH2:24]3)[cH:7][cH:8][n:9][c:10]2[cH:11][cH:12]1.[CH3:28][CH2:29][OH:30].[H:26][H:27]>>[CH3:1][O:2][c:3]1[n:4][c:5]2[c:6]([CH2:13][CH2:14][C:15]3([OH:25])[CH2:16][CH2:17][C:18]4([O:19][CH2:20][CH2:21][O:22]4)[CH2:23][CH2:24]3)[cH:7][cH:8][n:9][c:10]2[cH:11][cH:12]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-ccd542a1c24a4884984fcb9e008c2737
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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