Water → HCID 86640674, 화합물
반응식
[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[s:6][cH:7][c:8]([C:10](=[O:11])[NH2:12])[n:9]1.[CH3:24][CH2:25][O:26][C:27](=[O:28])[CH3:29].[OH2:30].[c:13]1([CH3:14])[cH:15][cH:16][c:17]([S:18]([Cl:19])(=[O:20])=[O:21])[cH:22][cH:23]1.[cH:31]1[cH:32][cH:33][n:34][cH:35][cH:36]1>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[s:6][cH:7][c:8]([C:10]#[N:12])[n:9]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-0b9b15ba430a4ebca52ef217b14b8097
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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