Acetate → HCID 86591374, 화합물
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[Br-:1].[C:27]([O-:28])(=[O:29])[CH3:30].[CH2:33]([OH:34])[CH3:35].[ClH:21].[F:2][c:3]1[c:4]2[c:11]([cH:12][cH:13][cH:14]1)[CH2:10][CH:9]1[CH2:8][CH2:7][CH:6]([CH2:5]2)[C:15]1=[N+:16]1[CH2:17][CH2:18][CH2:19][CH2:20]1.[NH2:22][OH:23].[Na+:31].[OH2:24].[OH2:25].[OH2:26].[OH2:32].[OH2:36]>>[F:2][c:3]1[c:4]2[c:11]([cH:12][cH:13][cH:14]1)[CH2:10][CH:9]1[CH2:8][CH2:7][CH:6]([CH2:5]2)[C:15]1=[N:16][OH:29]참가 물질
9
출처 및 근거
- ORD 기록
- ord-1cc65bef13754ee283149308d21a4468
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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