Acetic Acid → HCID 53968269, 화합물
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[C:3]([BH3-:4])#[N:5].[CH2:1]=[O:2].[CH3:22][C:23](=[O:24])[OH:25].[CH3:26][C:27]#[N:28].[Cl:8][c:9]1[cH:10][cH:11][c:12]2[c:13]([cH:21]1)[CH:14]=[CH:15][CH:16]([NH:19][CH3:20])[CH2:17][CH2:18]2.[ClH:7].[Na+:6]>>[CH3:3][N:19]([CH:16]1[CH:15]=[CH:14][c:13]2[c:12]([cH:11][cH:10][c:9]([Cl:8])[cH:21]2)[CH2:18][CH2:17]1)[CH3:20]참가 물질
8
출처 및 근거
- ORD 기록
- ord-ef3900893e7646bca8a354d2b0fca7b7
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
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