Water → HCID 18766305, 화합물
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[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([NH:7][C:8]([c:9]2[cH:10][cH:11][c:12]([CH:15]=[O:16])[cH:13][cH:14]2)=[O:17])[cH:18][cH:19]1.[F:20][c:21]1[c:22]([C:28]([CH:29]([CH2:30][CH:31]([CH2:32][OH:33])[CH2:34][OH:35])[CH3:36])([CH2:37][n:38]2[n:39][cH:40][n:41][cH:42]2)[OH:43])[cH:23][cH:24][c:25]([F:27])[cH:26]1.[OH2:44].[c:45]1([CH3:46])[cH:47][cH:48][c:49]([S:50]([OH:51])(=[O:52])=[O:53])[cH:54][cH:55]1>>[C:1](#[N:2])[c:3]1[cH:4][cH:5][c:6]([NH:7][C:8]([c:9]2[cH:10][cH:11][c:12]([CH:15]3[O:16][CH2:34][CH:31]([CH2:30][CH:29]([C:28]([c:22]4[c:21]([F:20])[cH:26][c:25]([F:27])[cH:24][cH:23]4)([CH2:37][n:38]4[n:39][cH:40][n:41][cH:42]4)[OH:43])[CH3:36])[CH2:32][O:33]3)[cH:13][cH:14]2)=[O:17])[cH:18][cH:19]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-04108a327d304ee8b71e416d9e79cc92
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)