Citric Acid → 4-[2-(2-Chlorophenyl)-2-oxoethyl]benzoic acid

HRID 1124894

반응식

HRID 1124894 반응식
[CH3:36][OH:37].[Cl:1][c:2]1[c:3]([C:8]([CH2:9][c:10]2[cH:11][cH:12][c:13]([C:14](=[O:15])[O:16][CH3:17])[cH:18][cH:19]2)=[O:20])[cH:4][cH:5][cH:6][cH:7]1.[Na+:22].[OH-:21].[OH2:38].[OH:23][C:24]([CH2:25][C:26]([C:27](=[O:28])[OH:29])([CH2:30][C:31](=[O:32])[OH:33])[OH:34])=[O:35]>>[Cl:1][c:2]1[c:3]([C:8]([CH2:9][c:10]2[cH:11][cH:12][c:13]([C:14](=[O:15])[OH:16])[cH:18][cH:19]2)=[O:20])[cH:4][cH:5][cH:6][cH:7]1

참가 물질

7

출처 및 근거

ORD 기록
ord-6f499ce99fde46d9a7cc412390fd7426
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

연결된 노트

불러오는 중…