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Water → 1-[2-Fluoro-5-(4-oxo-3,4-dihydrophthalazin-1-ylmethyl)phenyl]-3-hex-2-enylpyrrolidine-2,5-dione

HRID 1541619
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인쇄 미리보기

반응식

HRID 1541619 반응식
[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[CH:1]([N:2]([CH:3]([CH3:4])[CH3:5])[CH2:6][CH3:7])([CH3:8])[CH3:9].[F:10][c:11]1[c:12]([NH:29][C:30](=[O:31])[CH2:32][CH:33]([C:34](=[O:35])[OH:36])[CH2:37][CH:38]=[CH:39][CH2:40][CH2:41][CH3:42])[cH:13][c:14]([CH2:17][c:18]2[n:19][nH:20][c:21](=[O:28])[c:22]3[cH:23][cH:24][cH:25][cH:26][c:27]23)[cH:15][cH:16]1.[OH2:43]>>[F:10][c:11]1[c:12]([N:29]2[C:30](=[O:31])[CH2:32][CH:33]([CH2:37][CH:38]=[CH:39][CH2:40][CH2:41][CH3:42])[C:34]2=[O:36])[cH:13][c:14]([CH2:17][c:18]2[n:19][nH:20][c:21](=[O:28])[c:22]3[cH:23][cH:24][cH:25][cH:26][c:27]23)[cH:15][cH:16]1
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 962WaterHCID 6228DimethylformamideHCID 81531DiisopropylethylamineHCID 686238932-{[2-Fluoro-5-(4-oxo-3,4-dihydrophthalazin-1-ylmethyl)phenylcarbamoyl]methyl}oct-4-enoic acid

생성물 1

HCID 686243611-[2-Fluoro-5-(4-oxo-3,4-dihydrophthalazin-1-ylmethyl)phenyl]-3-hex-2-enylpyrrolidine-2,5-dione

출처 및 근거

ORD 기록
ord-23720b1e92cb4e73aaa7b14a443b4097
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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