Water → 4-hydroxy-3-[3-[3-[(methoxycarbonyl)methoxy]phenyl]-1-oxo-2-propenyl]-6-methyl-2(1H)-pyridinone

HRID 304386노트

반응식

HRID 304386 반응식
[C:1]([CH3:2])(=[O:3])[c:4]1[c:5](=[O:12])[nH:6][c:7]([CH3:11])[cH:8][c:9]1[OH:10].[CH2:34]1[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]1.[CH3:13][O:14][C:15](=[O:16])[CH2:17][O:18][c:19]1[cH:20][c:21]([CH:22]=[O:23])[cH:24][cH:25][cH:26]1.[OH2:27].[cH:28]1[cH:29][cH:30][n:31][cH:32][cH:33]1>>[C:1]([CH:2]=[CH:22][c:21]1[cH:20][c:19]([O:18][CH2:17][C:15]([O:14][CH3:13])=[O:16])[cH:26][cH:25][cH:24]1)(=[O:3])[c:4]1[c:5](=[O:12])[nH:6][c:7]([CH3:11])[cH:8][c:9]1[OH:10]

참가 물질

6

출처 및 근거

ORD 기록
ord-b60376b551644caca6c1600b683ab0e2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

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