Ethanol → HCID 19989935, 화합물
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[C:32](=[O:33])([OH:34])[O-:35].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][CH2:8][N:9]1[CH2:10][CH2:11][CH:12]([C:15]([OH:16])([c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)[c:24]2[cH:25][cH:26][c:27]([F:30])[cH:28][cH:29]2)[CH2:13][CH2:14]1)=[O:31].[CH3:37][CH2:38][OH:39].[Na+:36].[OH2:40]>>[O:3]=[C:4]([CH2:5][CH2:6][CH2:7][CH2:8][N:9]1[CH2:10][CH2:11][CH:12]([C:15]([OH:16])([c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)[c:24]2[cH:25][cH:26][c:27]([F:30])[cH:28][cH:29]2)[CH2:13][CH2:14]1)[OH:31]참가 물질
6
출처 및 근거
- ORD 기록
- ord-7d051ba0597d4e45b039dd6d78c2ed78
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
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