Acetic Acid → HCID 67996287, 화합물
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[BH4-:34].[CH3:31][CH2:32][OH:33].[CH3:36][C:37](=[O:38])[OH:39].[F:1][c:2]1[c:3]([NH:17][C:18](=[O:19])[c:20]2[cH:21][c:22]3[c:23]([s:24]2)[CH2:25][C:26]([CH3:29])([CH3:30])[C:27]3=[O:28])[cH:4][c:5]([B:8]2[O:9][C:10]([CH3:15])([CH3:16])[C:11]([CH3:13])([CH3:14])[O:12]2)[cH:6][cH:7]1.[Na+:35]>>[F:1][c:2]1[c:3]([NH:17][C:18](=[O:19])[c:20]2[cH:21][c:22]3[c:23]([s:24]2)[CH2:25][C:26]([CH3:29])([CH3:30])[CH:27]3[OH:28])[cH:4][c:5]([B:8]2[O:9][C:10]([CH3:15])([CH3:16])[C:11]([CH3:13])([CH3:14])[O:12]2)[cH:6][cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-83d96c3a0b824ff2b582616d6100d125
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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