Acetic Acid → 1-Cyclopropyl-6,7-difluoro-8-methyl-1,4-dihydro-4-oxoquinoline-3-carboxylic acid
반응식
[CH3:25][C:26](=[O:27])[OH:28].[CH:1]1([n:4]2[cH:5][c:6]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[c:7](=[O:17])[c:8]3[cH:9][c:10]([F:16])[c:11]([F:15])[c:12]([CH3:14])[c:13]23)[CH2:2][CH2:3]1.[ClH:23].[OH2:24]>>[CH:1]1([n:4]2[cH:5][c:6]([C:18](=[O:19])[OH:20])[c:7](=[O:17])[c:8]3[cH:9][c:10]([F:16])[c:11]([F:15])[c:12]([CH3:14])[c:13]23)[CH2:2][CH2:3]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-5b0b8536c02044f2a5382f338461cfde
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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