1-(2-Hydroxyethyl)-6,7,8-trifluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acid → 1-(2-Hydroxyethyl)-6,8-difluoro-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-7-yl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
반응식
[OH:1][CH2:2][CH2:3][n:4]1[cH:5][c:6]([C:18](=[O:19])[OH:20])[c:7](=[O:17])[c:8]2[cH:9][c:10]([F:16])[c:11]([F:15])[c:12]([F:14])[c:13]12.[n:21]1[cH:22][cH:23][n:24]2[c:25]1[CH2:26][NH:27][CH2:28][CH2:29]2>>[OH:1][CH2:2][CH2:3][n:4]1[cH:5][c:6]([C:18](=[O:19])[OH:20])[c:7](=[O:17])[c:8]2[cH:9][c:10]([F:16])[c:11]([N:27]3[CH2:26][c:25]4[n:21][cH:22][cH:23][n:24]4[CH2:29][CH2:28]3)[c:12]([F:14])[c:13]12참가 물질
3
출처 및 근거
- ORD 기록
- ord-1adfaac0a5f04f15bc4b65f5dd88921b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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