Ethanol → HCID 9834903, 화합물
반응식
[CH2:1]1[CH2:2][NH:3][CH2:4][c:5]2[cH:6][cH:7][cH:8][c:9]3[c:13]2[N:12]1[CH:11]1[CH:10]3[CH2:16][CH2:15][CH2:14]1.[CH3:19][CH2:20][OH:21].[H:17][H:18]>>[CH2:1]1[CH2:2][N:3]([C:20]([CH3:19])=[O:21])[CH2:4][c:5]2[cH:6][cH:7][cH:8][c:9]3[c:13]2[N:12]1[CH:11]1[CH:10]3[CH2:16][CH2:15][CH2:14]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-fef8130ebb884a52bfb8ac5c8cad763d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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