Methanol → 4-[4-(2-Adamantylcarbamoyl)-5-cyclopentylsulfanyl-pyrazol-1-yl]benzoic acid
반응식
[CH3:37][OH:38].[CH:3]12[CH:4]([NH:13][C:14](=[O:15])[c:16]3[cH:17][n:18][n:19](-[c:27]4[cH:28][cH:29][c:30]([C:31](=[O:32])[O:33][CH3:34])[cH:35][cH:36]4)[c:20]3[S:21][CH:22]3[CH2:23][CH2:24][CH2:25][CH2:26]3)[CH:5]3[CH2:6][CH:7]([CH2:8][CH:9]([CH2:10]1)[CH2:11]3)[CH2:12]2.[Na+:2].[OH-:1]>>[CH:3]12[CH:4]([NH:13][C:14](=[O:15])[c:16]3[cH:17][n:18][n:19](-[c:27]4[cH:28][cH:29][c:30]([C:31](=[O:32])[OH:33])[cH:35][cH:36]4)[c:20]3[S:21][CH:22]3[CH2:23][CH2:24][CH2:25][CH2:26]3)[CH:5]3[CH2:6][CH:7]([CH2:8][CH:9]([CH2:10]1)[CH2:11]3)[CH2:12]2참가 물질
5
출처 및 근거
- ORD 기록
- ord-d6dd2a12ad904b01bd53f7de9929f3fe
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D