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Potassium Cation → N,N'-bis[2,3-bis(acetyloxy)propyl]-5-(3-bromo-2-oxo-1-piperidinyl]-2,4,6-triiodo-1,3-benzenedicarboxamide

HRID 281930
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HRID 281930 반응식
[C:1]([CH3:2])(=[O:3])[O:4][CH:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]1[c:11]([I:41])[c:12]([C:27](=[O:28])[NH:29][CH2:30][CH:31]([CH2:32][O:33][C:34]([CH3:35])=[O:36])[O:37][C:38]([CH3:39])=[O:40])[c:13]([I:26])[c:14]([NH:17][C:18]([CH:19]([CH2:20][CH2:21][CH2:22][Br:23])[Br:24])=[O:25])[c:15]1[I:16])[CH2:42][O:43][C:44]([CH3:45])=[O:46].[C:47](=[O:48])([O-:49])[O-:50].[CH3:53][N:54]([CH3:55])[C:56](=[O:57])[CH3:58].[CH3:59][CH2:60][O:61][C:62](=[O:63])[CH3:64].[K+:51].[K+:52]>>[C:1]([CH3:2])(=[O:3])[O:4][CH:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]1[c:11]([I:41])[c:12]([C:27](=[O:28])[NH:29][CH2:30][CH:31]([CH2:32][O:33][C:34]([CH3:35])=[O:36])[O:37][C:38]([CH3:39])=[O:40])[c:13]([I:26])[c:14]([N:17]2[C:18](=[O:25])[CH:19]([Br:24])[CH2:20][CH2:21][CH2:22]2)[c:15]1[I:16])[CH2:42][O:43][C:44]([CH3:45])=[O:46]
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HCID 813Potassium Cation2회HCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 31374DimethylacetamideHCID 19048400N,N'-bis[2,3-bis(acetyloxy)propyl]-5-[(2,5-dibromo-1-oxopentyl)amino]-2,4,6-triiodo-1,3-benzenedicarboxamide

생성물 1

HCID 19048418
N,N'-bis[2,3-bis(acetyloxy)propyl]-5-(3-bromo-2-oxo-1-piperidinyl]-2,4,6-triiodo-1,3-benzenedicarboxamide

출처 및 근거

ORD 기록
ord-04a4fa2810644d70b2f0b7331c0614c7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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