Acetic Acid → HCID 178510171, 화합물
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[CH3:21][C:22](=[O:23])[OH:24].[F:1][CH:2]1[CH2:3][CH:4]([C:18]#[N:19])[N:5]([C:7]([CH2:8][O:9][Si:10]([C:11]([CH3:12])([CH3:13])[CH3:14])([CH3:15])[CH3:16])=[O:17])[CH2:6]1.[O:25]1[CH2:26][CH2:27][CH2:28][CH2:29]1.[OH2:20]>>[F:1][CH:2]1[CH2:3][CH:4]([C:18]#[N:19])[N:5]([C:7]([CH2:8][OH:9])=[O:17])[CH2:6]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-aefb69d468d146a8b92891f21e7d0fb2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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