Acetone → 1-(8,9-Dihydroxynonyl)-3,7-dimethylxanthine

HRID 178963노트

반응식

HRID 178963 반응식
[C:40]([OH:41])([CH3:42])([CH3:43])[CH3:44].[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH:8]=[CH2:9])[n:10]1[c:11](=[O:12])[n:13]([CH3:22])[c:14]2[n:15][cH:16][n:17]([CH3:21])[c:18]2[c:19]1=[O:20].[CH3:23][N+:24]1([O-:25])[CH2:26][CH2:28][O:27][CH2:29][CH2:30]1.[CH3:45][C:46](=[O:47])[CH3:48].[Na+:38].[Na+:39].[O:49]=[Os:50](=[O:51])(=[O:52])=[O:53].[OH2:31].[S:32]([S:33]([O-:34])=[O:35])([O-:36])=[O:37]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH:8]([CH2:9][OH:27])[OH:31])[n:10]1[c:11](=[O:12])[n:13]([CH3:22])[c:14]2[n:15][cH:16][n:17]([CH3:21])[c:18]2[c:19]1=[O:20]

참가 물질

9

출처 및 근거

ORD 기록
ord-c0a58f44eecf47089013d206603e4bee
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

반응 노트

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