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Methanol → Triethylamine

HRID 1209748
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HRID 1209748 반응식
[CH3:40][OH:41].[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[F:1][c:2]1[c:3]([NH:24][C:25](=[O:26])[C:27]2([C:30](=[O:31])[O:32][CH2:33][c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)[CH2:28][CH2:29]2)[cH:4][c:5]([F:23])[c:6]([O:8][c:9]2[cH:10][c:11]([NH:15][C:16](=[O:17])[N:18]3[CH2:19][CH:20]([OH:22])[CH2:21]3)[n:12][cH:13][cH:14]2)[cH:7]1.[H:42][H:43].[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1>>[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[F:1][c:2]1[c:3]([NH:24][C:25](=[O:26])[C:27]2([C:30](=[O:31])[OH:32])[CH2:28][CH2:29]2)[cH:4][c:5]([F:23])[c:6]([O:8][c:9]2[cH:10][c:11]([NH:15][C:16](=[O:17])[N:18]3[CH2:19][CH:20]([OH:22])[CH2:21]3)[n:12][cH:13][cH:14]2)[cH:7]1
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7

반응물 5

HCID 887MethanolHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 24788565Benzyl 1-[({2,5-difluoro-4-[(2-{[(3-hydroxyazetidin-1-yl)carbonyl]amino}pyridin-4-yl)oxy]phenyl}amino)carbonyl]cyclopropanecarboxylateHCID 178418361HCID 178418361, 화합물

생성물 2

HCID 8471Triethylamine
HCID 24788562
1-[[2,5-Difluoro-4-[[2-[(3-hydroxyazetidine-1-carbonyl)amino]-4-pyridinyl]oxy]phenyl]carbamoyl]cyclopropane-1-carboxylic acid

출처 및 근거

ORD 기록
ord-6b3bb229aaee47e6977b9be069aea89b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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