Toluene → HCID 3673519, 화합물
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[CH2:9]([O:10][CH:12]=[C:13]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[C:19]#[N:20])[CH3:11].[CH3:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[NH2:1][c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1[CH3:8]>>[NH:1]([c:2]1[n:3][cH:4][cH:5][cH:6][c:7]1[CH3:8])[CH:12]=[C:13]([C:14](=[O:15])[O:16][CH2:17][CH3:18])[C:19]#[N:20]참가 물질
4
출처 및 근거
- ORD 기록
- ord-4fcbccbffb684ab7805484085ead5cd5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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