Ethylene Glycol → HCID 21132020, 화합물
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[C:1](=[O:2])([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[N:9]1[CH2:10][CH2:11][CH:12]2[NH:13][c:14]3[cH:15][c:16]([Cl:24])[c:17]([Cl:23])[cH:18][c:19]3[CH:20]2[CH2:21][CH2:22]1.[K+:26].[OH-:25].[OH2:31].[OH:27][CH2:28][CH2:29][OH:30]>>[NH:9]1[CH2:10][CH2:11][CH:12]2[NH:13][c:14]3[cH:15][c:16]([Cl:24])[c:17]([Cl:23])[cH:18][c:19]3[CH:20]2[CH2:21][CH2:22]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-a55244f218304106b715e81d64e37cd0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
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