Water → HCID 20096580, 화합물
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[CH2:4]([CH3:5])[O:6][C:7](=[O:8])[NH:9][c:10]1[c:11]([N+:27](=[O:28])[O-:29])[cH:12][c:13]([N:16]2[C:17](=[O:18])[c:19]3[cH:20][cH:21][cH:22][cH:23][c:24]3[C:25]2=[O:26])[cH:14][cH:15]1.[CH3:30][O:31][CH2:32][CH2:33][O:34][CH3:35].[NH2:2][NH2:3].[OH2:1]>>[CH2:4]([CH3:5])[O:6][C:7](=[O:8])[NH:9][c:10]1[c:11]([N+:27](=[O:28])[O-:29])[cH:12][c:13]([NH2:16])[cH:14][cH:15]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-6c69ddc29b65456c9d77d053784cc40b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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