Toluene → HCID 178472001, 화합물

HRID 1555778

반응식

HRID 1555778 반응식
[CH3:19][C:20]([O:21][C:22]([CH3:23])=[O:24])=[O:25].[CH3:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1.[CH:26]([O:27][CH2:28][CH3:29])([O:30][CH2:31][CH3:32])[O:33][CH2:34][CH3:35].[F:1][c:2]1[c:3]([C:4](=[O:5])[CH2:6][C:7](=[O:8])[O:9][CH2:10][CH3:11])[cH:12][c:13]([F:18])[c:14]([F:17])[c:15]1[F:16].[NH2:36][C:37]([CH2:38][CH2:39][OH:40])([CH3:41])[CH3:42]>>[F:1][c:2]1[c:3]([C:4](=[O:5])[C:6]([C:7](=[O:8])[O:9][CH2:10][CH3:11])=[CH:19][NH:36][C:37]([CH2:38][CH2:39][OH:40])([CH3:41])[CH3:42])[cH:12][c:13]([F:18])[c:14]([F:17])[c:15]1[F:16]

참가 물질

6

출처 및 근거

ORD 기록
ord-b344c41480f446da951fe6529dd6f434
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

연결된 노트

불러오는 중…