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Potassium Cation → 1-[2-(1-Adamantyl)ethyl]-1-[2-[N-(2-methoxyethyl)-N-methylamino]ethyl]-3-[3-(4-pyridyl)propyl]urea

HRID 680141
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HRID 680141 반응식
[C:1]12([CH2:11][CH2:12][N:13]([C:14](=[O:15])[NH:16][CH2:17][CH2:18][CH2:19][c:20]3[cH:21][cH:22][n:23][cH:24][cH:25]3)[CH2:26][CH2:27][NH:28][CH3:29])[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2.[C:30](=[O:31])([O-:32])[O-:33].[CH3:38][O:39][CH2:40][CH2:41][Cl:42].[CH3:44][CH2:45][O:46][CH2:47][CH3:48].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[I-:37].[K+:34].[K+:35].[Na+:36].[OH2:43]>>[C:1]12([CH2:11][CH2:12][N:13]([C:14](=[O:15])[NH:16][CH2:17][CH2:18][CH2:19][c:20]3[cH:21][cH:22][n:23][cH:24][cH:25]3)[CH2:26][CH2:27][N:28]([CH3:29])[CH2:41][CH2:40][O:39][CH3:38])[CH2:2][CH:3]3[CH2:4][CH:5]([CH2:6][CH:7]([CH2:8]1)[CH2:9]3)[CH2:10]2
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 813Potassium Cation2회HCID 923Sodium IonHCID 962WaterHCID 3283Diethyl EtherHCID 6228DimethylformamideHCID 123162-Chloroethyl methyl etherHCID 19660Carbonate IonHCID 30165Iodide Ion
HCID 121366481-[2-(1-Adamantyl)ethyl]-1-(2-methylaminoethyl)-3-[3-(4-pyridyl)propyl]urea

생성물 1

HCID 121366521-[2-(1-Adamantyl)ethyl]-1-[2-[N-(2-methoxyethyl)-N-methylamino]ethyl]-3-[3-(4-pyridyl)propyl]urea

출처 및 근거

ORD 기록
ord-c42968d65e844f2fb324eee363948474
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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