Water → HCID 178472749, 화합물
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[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]([CH:8]([CH2:9][CH3:10])[CH3:11])[NH:12][CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18])=[O:19].[Cl:20][S:21](=[O:22])(=[O:23])[N:24]=[C:25]=[O:26].[Cl:28][CH2:29][Cl:30].[OH2:27]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]([CH:8]([CH2:9][CH3:10])[CH3:11])[N:12]([CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18])[C:25]([NH2:24])=[O:26])=[O:19]참가 물질
5
출처 및 근거
- ORD 기록
- ord-3ff9c351b3904de4abc053e3b91bf290
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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