Ethanol → HCID 20318415, 화합물
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[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([OH:19])[c:7]([CH3:18])[c:8]([CH3:17])[c:9]([CH2:11][CH2:12][C:13](=[O:14])[O:15][CH3:16])[cH:10]1.[CH3:22][CH2:23][OH:24].[Na+:21].[OH-:20].[OH2:25]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([OH:19])[c:7]([CH3:18])[c:8]([CH3:17])[c:9]([CH2:11][CH2:12][C:13](=[O:14])[OH:15])[cH:10]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-adb13c0e4b194152bf8c4ee5cea9eba0
- 출처 데이터셋
- Test data from https://doi.org/10.1039/C8SC04228D
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