Acetone → HCID 178429994, 화합물
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[C:34](=[O:35])([O-:36])[O-:37].[CH3:40][C:41](=[O:42])[CH3:43].[Cl:18][CH2:19][c:20]1[c:21]2[cH:22][cH:23][cH:24][cH:25][c:26]2[cH:27][c:28]2[cH:29][cH:30][cH:31][cH:32][c:33]12.[K+:38].[K+:39].[SH:1][CH2:2][CH:3]1[CH:4]([OH:17])[CH2:5][CH:6]([n:8]2[c:9](=[O:10])[nH:11][c:12](=[O:13])[c:14]([CH3:15])[cH:16]2)[O:7]1>>[S:1]([CH2:2][CH:3]1[CH:4]([OH:17])[CH2:5][CH:6]([n:8]2[c:9](=[O:10])[nH:11][c:12](=[O:13])[c:14]([CH3:15])[cH:16]2)[O:7]1)[CH2:19][c:20]1[c:21]2[cH:22][cH:23][cH:24][cH:25][c:26]2[cH:27][c:28]2[cH:29][cH:30][cH:31][cH:32][c:33]12참가 물질
6
출처 및 근거
- ORD 기록
- ord-165377da90ad431692f7291faf729bb5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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