Acetone → HCID 178487457, 화합물

HRID 114071

반응식

HRID 114071 반응식
[CH3:1][O:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8]([CH:13]([C:14](=[O:15])[OH:16])[CH3:17])[cH:9][c:10]2[cH:11][cH:12]1.[CH3:29][N:30]([CH3:31])[CH2:32][CH2:33][CH2:34][N:35]=[C:36]=[N:37][CH2:38][CH3:39].[CH3:40][N:41]([c:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1)[CH3:48].[CH3:49][C:50](=[O:51])[CH3:52].[ClH:28].[OH:18][CH2:19][C:20]([CH2:21][OH:22])([CH2:23][OH:24])[N+:25](=[O:26])[O-:27]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8]([CH:13]([C:14](=[O:15])[O:16][CH2:23][C:20]([CH2:19][OH:18])([CH2:21][OH:22])[N+:25](=[O:26])[O-:27])[CH3:17])[cH:9][c:10]2[cH:11][cH:12]1

참가 물질

7

출처 및 근거

ORD 기록
ord-9d13e4d1b60f487182de6df9dfc8b18a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

불러오는 중…