Water → HCID 18945259, 화합물
반응식
[CH3:21][CH2:22][N:23]([CH2:24][CH3:25])[CH2:26][CH3:27].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[Cl:28][C:29](=[O:30])[O:31][CH2:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[OH2:45].[OH:1][CH2:2][CH2:3][NH:4][CH2:5][c:6]1[cH:7][c:8]([C:9](=[O:10])[O:11][CH3:12])[cH:13][c:14](-[n:16]2[cH:17][cH:18][cH:19][cH:20]2)[cH:15]1>>[OH:1][CH2:2][CH2:3][N:4]([CH2:5][c:6]1[cH:7][c:8]([C:9](=[O:10])[O:11][CH3:12])[cH:13][c:14](-[n:16]2[cH:17][cH:18][cH:19][cH:20]2)[cH:15]1)[C:29](=[O:30])[O:31][CH2:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-1753845770d448ec80cd208075a65e50
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)