Ethanol → 6-(4-Hydroxy-3,5-diisopropyl-phenyl)-hexanoic acid ethyl ester

HRID 154422

반응식

HRID 154422 반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][CH2:8][C:9](=[O:10])[c:11]1[cH:12][c:13]([CH:21]([CH3:22])[CH3:23])[c:14]([OH:20])[c:15]([CH:17]([CH3:18])[CH3:19])[cH:16]1)=[O:24].[CH3:29][CH2:30][OH:31].[CH:25]([SH:26])([SH:27])[CH3:28].[Cl:32][CH2:33][Cl:34].[OH2:35]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][c:11]1[cH:12][c:13]([CH:21]([CH3:22])[CH3:23])[c:14]([OH:20])[c:15]([CH:17]([CH3:18])[CH3:19])[cH:16]1)=[O:24]

참가 물질

6

출처 및 근거

ORD 기록
ord-2912a4afda7b43039c37bb73b1f87611
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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