Methanol → (1RS,4SR,5RS)-4-(4-carboxypentyl)-4-methyl-3,8-dioxabicyclo[3.2.1]octane-1-ethanol
반응식
[C:1](=[O:2])([O:3][CH3:4])[CH:5]([CH2:6][CH2:7][CH2:8][C:9]1([CH3:20])[O:10][CH2:11][C:12]2([CH2:17][CH2:18][OH:19])[CH2:13][CH2:14][CH:15]1[O:16]2)[CH3:21].[CH3:22][OH:23].[Na+:25].[OH-:24].[OH2:26]>>[C:1](=[O:2])([OH:3])[CH:5]([CH2:6][CH2:7][CH2:8][C:9]1([CH3:20])[O:10][CH2:11][C:12]2([CH2:17][CH2:18][OH:19])[CH2:13][CH2:14][CH:15]1[O:16]2)[CH3:21]참가 물질
6
출처 및 근거
- ORD 기록
- ord-7e7978fb8766422f84c3e633cde28137
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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