Ammonium → HCID 54693166, 화합물
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[CH3:26][CH2:27][OH:28].[Cl-:23].[Fe:29].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7](-[c:10]2[cH:11][s:12][c:13]3[nH:14][c:15](=[O:22])[c:16]([C:20]#[N:21])[c:17]([OH:19])[c:18]23)[cH:8][cH:9]1.[NH4+:24].[OH2:25]>>[NH2:1][c:4]1[cH:5][cH:6][c:7](-[c:10]2[cH:11][s:12][c:13]3[nH:14][c:15](=[O:22])[c:16]([C:20]#[N:21])[c:17]([OH:19])[c:18]23)[cH:8][cH:9]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-458afaffc5f942408edf417245dcc3a4
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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