Hydrochloric Acid → [1-({[5-(4-Methoxyphenyl)-6-phenylfuro[2,3-d]pyrimidin-4-yl]oxy}methyl)cyclobutyl]methanol
반응식
[C:3]1([CH2:7][OH:8])([CH2:9][OH:10])[CH2:4][CH2:5][CH2:6]1.[CH2:55]([N+:56]([CH2:57][CH2:58][CH2:59][CH3:60])([CH2:61][CH2:62][CH2:63][CH3:64])[CH2:65][CH2:66][CH2:67][CH3:68])[CH2:69][CH2:70][CH3:71].[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[CH3:43][O:44][CH2:45][CH2:46][O:47][CH3:48].[Cl:11][c:12]1[c:13]2[c:14]([n:15][cH:16][n:17]1)[o:18][c:19](-[c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)[c:20]2-[c:21]1[cH:22][cH:23][c:24]([O:27][CH3:28])[cH:25][cH:26]1.[ClH:35].[Na+:2].[OH-:1].[OH2:49].[S:50]([O-:51])([OH:52])(=[O:53])=[O:54]>>[C:3]1([CH2:7][O:8][c:12]2[c:13]3[c:14]([n:15][cH:16][n:17]2)[o:18][c:19](-[c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:20]3-[c:21]2[cH:22][cH:23][c:24]([O:27][CH3:28])[cH:25][cH:26]2)([CH2:9][OH:10])[CH2:4][CH2:5][CH2:6]1참가 물질
11
반응물 10
생성물 1
출처 및 근거
- ORD 기록
- ord-44977fcbc95647e988e15ec716053683
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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