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Water → 5-chloro-1H-indole-2-carboxylic acid [1-benzyl-2-oxo-2-(4-oxo-piperidin-1-yl)-ethyl]-amide

HRID 210231
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인쇄 미리보기

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HRID 210231 반응식
[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[Cl:9][c:10]1[cH:11][c:12]2[cH:13][c:14]([C:19](=[O:20])[NH:21][CH:22]([C:23](=[O:24])[OH:25])[CH2:26][c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[nH:15][c:16]2[cH:17][cH:18]1.[NH:2]1[CH2:3][CH2:4][C:5](=[O:8])[CH2:6][CH2:7]1.[OH2:1]>>[N:2]1([C:23]([CH:22]([NH:21][C:19]([c:14]2[cH:13][c:12]3[cH:11][c:10]([Cl:9])[cH:18][cH:17][c:16]3[nH:15]2)=[O:20])[CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)=[O:24])[CH2:3][CH2:4][C:5](=[O:8])[CH2:6][CH2:7]1
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참가 물질

5

반응물 4

HCID 962WaterHCID 8857Ethyl AcetateHCID 337214-PiperidoneHCID 155210162-[(5-Chloro-1H-indole-2-carbonyl)-amino]-3-phenyl-propionic acid

생성물 1

HCID 543267115-chloro-1H-indole-2-carboxylic acid [1-benzyl-2-oxo-2-(4-oxo-piperidin-1-yl)-ethyl]-amide

출처 및 근거

ORD 기록
ord-4e9daa2bdfea420a86e9688eaf23557b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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