Acetic Acid → HCID 23103632, 화합물
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[C+4:18].[CH2:1]([CH3:2])[c:3]1[cH:4][cH:5][c:6]([CH:9]([OH:10])[c:11]2[n:12][cH:13][cH:14][cH:15][c:16]2[OH:17])[cH:7][cH:8]1.[CH3:26][C:27](=[O:28])[OH:29].[OH-:19].[OH-:21].[OH-:22].[OH-:23].[OH-:24].[OH-:25].[Pd+2:20]>>[CH2:1]([CH3:2])[c:3]1[cH:4][cH:5][c:6]([CH2:9][c:11]2[n:12][cH:13][cH:14][cH:15][c:16]2[OH:17])[cH:7][cH:8]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-1445f0e3829343fba1b9e8221e2e4a0f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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