Water → 5-[3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxo-1H-indol-4-yl]pent-4-ynoic acid
반응식
[CH2:27]1[O:28][CH2:29][CH2:30][CH2:31]1.[CH3:1][O:2][C:3]([CH2:4][CH2:5][C:6]#[C:7][c:8]1[c:9]2[c:13]([cH:14][cH:15][cH:16]1)[NH:12][C:11](=[O:17])[C:10]2=[CH:18][c:19]1[nH:20][cH:21][cH:22][c:23]1[O:24][CH3:25])=[O:26].[OH2:32]>>[O:2]=[C:3]([CH2:4][CH2:5][C:6]#[C:7][c:8]1[c:9]2[c:13]([cH:14][cH:15][cH:16]1)[NH:12][C:11](=[O:17])[C:10]2=[CH:18][c:19]1[nH:20][cH:21][cH:22][c:23]1[O:24][CH3:25])[OH:26]참가 물질
4
출처 및 근거
- ORD 기록
- ord-4112927db4b34460b03e7d760d0dd016
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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