HCID 10548559, 화합물 → HCID 9830016, 화합물
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[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9](-[c:17]2[cH:18][cH:19][c:20](-[c:23]3[cH:24][cH:25][c:26]([OH:29])[cH:27][cH:28]3)[cH:21][cH:22]2)[c:10]2[c:11]([s:12]1)[cH:13][cH:14][cH:15][cH:16]2.[Cl:30][S:31](=[O:32])(=[O:33])[c:34]1[cH:35][c:36]([OH:43])[c:37]([C:38](=[O:39])[OH:40])[cH:41][cH:42]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[c:9](-[c:17]2[cH:18][cH:19][c:20](-[c:23]3[cH:24][cH:25][c:26]([O:29][S:31](=[O:32])(=[O:33])[c:34]4[cH:35][c:36]([OH:43])[c:37]([C:38](=[O:39])[OH:40])[cH:41][cH:42]4)[cH:27][cH:28]3)[cH:21][cH:22]2)[c:10]2[c:11]([s:12]1)[cH:13][cH:14][cH:15][cH:16]2참가 물질
3
출처 및 근거
- ORD 기록
- ord-b4af65c4879348a7ae4124ed5a949426
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
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