Methane → HCID 23370086, 화합물
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[C:32].[CH3:29][CH2:30][OH:31].[N+:1]([O-:2])(=[O:3])[c:4]1[c:5]([O:6][CH2:7][CH2:8][CH2:9][c:10]2[cH:11][c:12]([C:21]([CH3:22])([CH3:23])[CH3:24])[c:13]([OH:20])[c:14]([C:16]([CH3:17])([CH3:18])[CH3:19])[cH:15]2)[cH:25][cH:26][cH:27][cH:28]1.[Pd:33]>>[NH2:1][c:4]1[c:5]([O:6][CH2:7][CH2:8][CH2:9][c:10]2[cH:11][c:12]([C:21]([CH3:22])([CH3:23])[CH3:24])[c:13]([OH:20])[c:14]([C:16]([CH3:17])([CH3:18])[CH3:19])[cH:15]2)[cH:25][cH:26][cH:27][cH:28]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-36bad2544156441ab52f00631f63707c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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