4-Hydroxy-4-(6-methoxypyridin-3-yl)cyclohexan-1-one → HCID 54755921, 화합물

HRID 200819

반응식

HRID 200819 반응식
[NH:1]1[CH2:2][CH:3]([NH:5][C:6]([CH2:7][NH:8][c:9]2[n:10][o:11][c:12]3[c:13]2[cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]3)=[O:22])[CH2:4]1.[OH:23][C:24]1([c:31]2[cH:32][n:33][c:34]([O:37][CH3:38])[cH:35][cH:36]2)[CH2:25][CH2:26][C:27](=[O:30])[CH2:28][CH2:29]1>>[N:1]1([CH:27]2[CH2:26][CH2:25][C:24]([OH:23])([c:31]3[cH:32][n:33][c:34]([O:37][CH3:38])[cH:35][cH:36]3)[CH2:29][CH2:28]2)[CH2:2][CH:3]([NH:5][C:6]([CH2:7][NH:8][c:9]2[n:10][o:11][c:12]3[c:13]2[cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]3)=[O:22])[CH2:4]1

참가 물질

3

출처 및 근거

ORD 기록
ord-8ac9aa38a9aa48919baf0862fd07840a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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