Water → N-[4-[2-[[6-[[2-(3-Hydroxyphenyl)-2-oxoethyl](phenylmethyl)amino]hexyl]oxy]ethyl]phenyl]acetamide

HRID 94739

반응식

HRID 94739 반응식
[Br:28][CH2:29][C:30](=[O:31])[c:32]1[cH:33][c:34]([OH:38])[cH:35][cH:36][cH:37]1.[Cl:39][CH2:40][Cl:41].[OH2:42].[c:1]1([CH2:7][NH:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][O:15][CH2:16][CH2:17][c:18]2[cH:19][cH:20][c:21]([NH:24][C:25]([CH3:26])=[O:27])[cH:22][cH:23]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][N:8]([CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][O:15][CH2:16][CH2:17][c:18]2[cH:19][cH:20][c:21]([NH:24][C:25]([CH3:26])=[O:27])[cH:22][cH:23]2)[CH2:29][C:30](=[O:31])[c:32]2[cH:33][c:34]([OH:38])[cH:35][cH:36][cH:37]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

참가 물질

5

출처 및 근거

ORD 기록
ord-08ceadcca3f64e8dbd48f03e14abfc20
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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