Acetonitrile → HCID 67612521, 화합물
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[C:1](=[O:2])([OH:3])[CH:4]1[N:5]([CH3:19])[CH2:6][CH:7]([S:9][CH2:10][c:11]2[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]2)[CH2:8]1.[CH3:29][C:30]#[N:31].[OH:20][CH2:21][CH2:22][N:23]1[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]1>>[C:1](=[O:3])([CH:4]1[N:5]([CH3:19])[CH2:6][CH:7]([S:9][CH2:10][c:11]2[cH:12][cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]2)[CH2:8]1)[N:26]1[CH2:25][CH2:24][N:23]([CH2:22][CH2:21][OH:20])[CH2:28][CH2:27]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-2e87feb79a954cf58a336487a632ab40
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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