Water → HCID 59850130, 화합물
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[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH3:36].[CH3:37][N:38]([CH3:39])[CH:40]=[O:41].[CH:42]([N:43]([CH:44]([CH3:45])[CH3:46])[CH2:47][CH3:48])([CH3:49])[CH3:50].[Cl:1][c:2]1[c:3]([N+:13](=[O:14])[O-:15])[cH:4][c:5]([C:9]([F:10])([F:11])[F:12])[c:6]([Cl:8])[cH:7]1.[NH2:16][CH:17]1[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]1.[OH2:30]>>[c:2]1([NH:16][CH:17]2[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]2)[c:3]([N+:13](=[O:14])[O-:15])[cH:4][c:5]([C:9]([F:10])([F:11])[F:12])[c:6]([Cl:8])[cH:7]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-bd9f360e39ec49dbbc8d620bdb4f4401
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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