Acetic Acid → 9-Fluoro-11-hydroxy-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,17-dione
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[CH3:29][C:30](=[O:31])[OH:32].[CH:33]([Cl:34])([Cl:35])[Cl:36].[F:1][C:2]12[C:3]3([CH3:28])[CH:4]=[CH:5][C:6](=[O:27])[CH:7]=[C:8]3[CH2:9][CH2:10][CH:11]1[CH:12]1[CH2:13][CH:14]([CH3:26])[C:15]([C:16](=[O:17])[CH2:18][OH:19])([OH:25])[C:20]1([CH3:24])[CH2:21][CH:22]2[OH:23]>>[F:1][C:2]12[C:3]3([CH3:28])[CH:4]=[CH:5][C:6](=[O:27])[CH:7]=[C:8]3[CH2:9][CH2:10][CH:11]1[CH:12]1[CH2:13][CH:14]([CH3:26])[C:15](=[O:25])[C:20]1([CH3:24])[CH2:21][CH:22]2[OH:23]참가 물질
4
출처 및 근거
- ORD 기록
- ord-facce341a5ff419cbb2e738ebcb753db
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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