Acetic Acid → HCID 15644271, 화합물
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[CH2:32]([Cl:33])[Cl:34].[CH3:15][C:16]([NH2:17])=[O:18].[CH3:21][C:22](=[O:23])[OH:24].[CH3:25][C:26]([O:27][C:28](=[O:29])[CH3:30])=[O:31].[CH:1]1([C:5]([C:6]#[CH:7])([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[OH:14])[CH2:2][CH2:3][CH2:4]1.[K+:20].[OH-:19].[OH2:35]>>[CH:1]1([C:5]([C:6]([CH3:7])=[O:18])([c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[OH:14])[CH2:2][CH2:3][CH2:4]1참가 물질
9
출처 및 근거
- ORD 기록
- ord-eedb51abff3e455ba1b616bcebb47940
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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