Acetate → 3,5,5-Trichloro-4-hydroxycyclopent-2-en-1-one
반응식
[C:14]([O-:15])(=[O:16])[CH3:17].[C:18]([O-:19])(=[O:20])[CH3:21].[C:22]([O-:23])(=[O:24])[CH3:25].[C:26]([O-:27])(=[O:28])[CH3:29].[CH3:32][C:33](=[O:34])[OH:35].[Cl:1][C:2]1=[CH:3][C:4]([C:10]([OH:11])=[O:12])([OH:13])[C:5]([Cl:8])([Cl:9])[CH:6]1[OH:7].[OH2:31].[Pb+4:30]>>[Cl:1][C:2]1=[CH:3][C:4](=[O:13])[C:5]([Cl:8])([Cl:9])[CH:6]1[OH:7]참가 물질
6
출처 및 근거
- ORD 기록
- ord-7d1eb22c9a9546cfa8109822cbda5fa0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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