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Lactic Acid → [1-[(2,4-Dimethoxyphenyl)methyl]-4-oxo-3-[(2-phenylacetyl)amino]azetidin-2-yl]methyl 4-methylbenzenesulfonate

HRID 1128039
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HRID 1128039 반응식
[CH3:1][O:2][c:3]1[c:4]([CH2:5][N:6]2[C:7](=[O:22])[CH:8]([NH:12][C:13]([CH2:14][c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)=[O:21])[CH:9]2[CH2:10][OH:11])[cH:23][cH:24][c:25]([O:27][CH3:28])[cH:26]1.[CH3:40][CH:41]([C:42](=[O:43])[OH:44])[OH:45].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[O:58]1[CH2:59][CH2:60][CH2:61][CH2:62]1.[c:29]1([CH3:39])[cH:30][cH:31][c:32]([S:35](=[O:36])(=[O:37])[Cl:38])[cH:33][cH:34]1.[cH:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1>>[CH3:1][O:2][c:3]1[c:4]([CH2:5][N:6]2[C:7](=[O:22])[CH:8]([NH:12][C:13]([CH2:14][c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)=[O:21])[CH:9]2[CH2:10][O:11][S:35]([c:32]2[cH:31][cH:30][c:29]([CH3:39])[cH:34][cH:33]2)(=[O:36])=[O:37])[cH:23][cH:24][c:25]([O:27][CH3:28])[cH:26]1
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7

반응물 6

HCID 612Lactic AcidHCID 1049PyridineHCID 73974-Toluenesulfonyl chlorideHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 14230547N-[1-[(2,4-dimethoxyphenyl)methyl]-2-(hydroxymethyl)-4-oxoazetidin-3-yl]-2-phenylacetamide

생성물 1

HCID 14230549
[1-[(2,4-Dimethoxyphenyl)methyl]-4-oxo-3-[(2-phenylacetyl)amino]azetidin-2-yl]methyl 4-methylbenzenesulfonate

출처 및 근거

ORD 기록
ord-d69409c60b7c4349a4a9784cf7d78d77
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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