Formic Acid → 3-(4-Isopropylphenyl)-1',4,6,7-tetramethylspiro[benzofuran-2(3H), 4'-piperidine]-5-ol
반응식
[CH:2]([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH:11]2[C:12]3([O:13][c:14]4[c:15]2[c:16]([CH3:23])[c:17]([OH:22])[c:18]([CH3:21])[c:19]4[CH3:20])[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]3)[cH:9][cH:10]1.[CH:31]([OH:32])=[O:33].[ClH:1].[Na+:30].[OH-:29]>>[CH:2]([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH:11]2[C:12]3([O:13][c:14]4[c:15]2[c:16]([CH3:23])[c:17]([OH:22])[c:18]([CH3:21])[c:19]4[CH3:20])[CH2:24][CH2:25][N:26]([CH3:31])[CH2:27][CH2:28]3)[cH:9][cH:10]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-a2001e367f204dfa9f6b98b8fe1cdc58
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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