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Water → 1-Benzhydryl-4-(5-(2,3,4-trimethoxyphenyl)-2,4-pentadienoyl)piperazine

HRID 86582
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HRID 86582 반응식
[C:60]([O:61][CH2:62][CH3:63])(=[O:64])[CH3:65].[CH2:27]([C:28]([Cl:29])=[O:30])[CH3:31].[CH3:1][O:2][c:3]1[c:4]([CH:13]=[CH:14][CH:15]=[CH:16][C:17](=[O:18])[OH:19])[cH:5][cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10].[CH3:20][CH2:21][N:22]([CH2:23][CH3:24])[CH2:25][CH3:26].[CH3:54][CH2:55][CH2:56][CH2:57][CH2:58][CH3:59].[CH:32]([c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)([c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1)[N:45]1[CH2:46][CH2:47][NH:48][CH2:49][CH2:50]1.[Cl:51][CH2:52][Cl:53].[OH2:66]>>[CH3:1][O:2][c:3]1[c:4]([CH:13]=[CH:14][CH:15]=[CH:16][C:17](=[O:19])[N:48]2[CH2:47][CH2:46][N:45]([CH:32]([c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[c:39]3[cH:40][cH:41][cH:42][cH:43][cH:44]3)[CH2:50][CH2:49]2)[cH:5][cH:6][c:7]([O:11][CH3:12])[c:8]1[O:9][CH3:10]
참가 물질출처 및 근거반응 노트

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9

반응물 8

HCID 962WaterHCID 6344DichloromethaneHCID 8058HexaneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 62324Propionyl chlorideHCID 70048BenzhydrylpiperazineHCID 53824140
5-(2,3,4-Trimethoxyphenyl)-2,4-pentadienoic acid

생성물 1

HCID 538213461-Benzhydryl-4-(5-(2,3,4-trimethoxyphenyl)-2,4-pentadienoyl)piperazine

출처 및 근거

ORD 기록
ord-897549896a82441d9ad23b93da04936e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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