Methyl 2-phenyl-2-propylpentanoate → HCID 68870310, 화합물
반응식
[CH2:1]([CH2:2][CH:3]([CH3:4])[CH3:5])[C:6]([C:7](=[O:8])[O:9][CH3:10])([CH2:11][CH2:12][CH:13]([CH3:14])[CH3:15])[c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1.[c:22]1([C:23]([CH2:24][CH2:25][CH3:26])([CH2:27][CH2:28][CH3:29])[C:30]([O:31][CH3:32])=[O:33])[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[CH2:1]([CH2:2][CH:3]([CH3:4])[CH3:5])[C:6]([C:7](=[O:8])[OH:9])([CH2:11][CH2:12][CH:13]([CH3:14])[CH3:15])[c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-a5e530569ccf49a48b4f8bc491dadcc5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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