Water → HCID 178468238, 화합물

HRID 2123593

반응식

HRID 2123593 반응식
[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:18][S:19](=[O:20])(=[O:21])[c:22]1[cH:23][cH:24][c:25]([C:26](=[O:27])[NH:28][NH2:29])[cH:30][cH:31]1.[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[Cl:1][c:2]1[cH:3][c:4]([NH:10][CH:11]([C:12](=[O:13])[OH:14])[CH:15]([CH3:16])[OH:17])[cH:5][cH:6][c:7]1[C:8]#[N:9].[OH2:32].[OH:33][n:34]1[c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]2[n:41][n:42]1>>[Cl:1][c:2]1[cH:3][c:4]([NH:10][CH:11]([C:12](=[O:14])[NH:29][NH:28][C:26]([c:25]2[cH:24][cH:23][c:22]([S:19]([CH3:18])(=[O:20])=[O:21])[cH:31][cH:30]2)=[O:27])[CH:15]([CH3:16])[OH:17])[cH:5][cH:6][c:7]1[C:8]#[N:9]

참가 물질

7

출처 및 근거

ORD 기록
ord-e02b857781af4ab88c228075915ec183
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

연결된 노트

불러오는 중…