4-Ethynylheptan-4-ol → HCID 86628465, 화합물
반응식
[Br:1][c:2]1[cH:3][c:4]([CH:10]([CH2:11][CH2:12][NH:13][C:14]([C:15]([F:16])([F:17])[F:18])=[O:19])[OH:20])[cH:5][cH:6][c:7]1[O:8][CH3:9].[C:21](#[CH:22])[C:23]([CH2:24][CH2:25][CH3:26])([CH2:27][CH2:28][CH3:29])[OH:30]>>[c:2]1([C:22]#[C:21][C:23]([CH2:24][CH2:25][CH3:26])([CH2:27][CH2:28][CH3:29])[OH:30])[cH:3][c:4]([CH:10]([CH2:11][CH2:12][NH:13][C:14]([C:15]([F:16])([F:17])[F:18])=[O:19])[OH:20])[cH:5][cH:6][c:7]1[O:8][CH3:9]참가 물질
3
출처 및 근거
- ORD 기록
- ord-052c375e50af480fa2b7b364a802de5f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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