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Sodium Ion → 4-[2-(5-Ethyl-2-pyridinyl)-4-methyl-5-oxo-4-propan-2-ylimidazol-1-yl]but-2-enoic acid

HRID 2314312
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반응식

HRID 2314312 반응식
[CH2:1]([CH3:2])[c:3]1[cH:4][cH:5][c:6]([C:9]2=[N:13][C:12]([CH3:14])([CH:15]([CH3:16])[CH3:17])[C:11](=[O:18])[N:10]2[CH2:19][CH:20]=[CH:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[n:7][cH:8]1.[Na+:34].[O:28]1[CH2:29][CH2:30][CH2:31][CH2:32]1.[OH-:33].[OH2:27].[OH2:35]>>[CH2:1]([CH3:2])[c:3]1[cH:4][cH:5][c:6]([C:9]2=[N:13][C:12]([CH3:14])([CH:15]([CH3:16])[CH3:17])[C:11](=[O:18])[N:10]2[CH2:19][CH:20]=[CH:21][C:22](=[O:23])[OH:24])[n:7][cH:8]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 923Sodium IonHCID 961HydroxideHCID 962Water2회HCID 8028TetrahydrofuranHCID 54071500Ethyl 4-[2-(5-ethyl-2-pyridinyl)-4-methyl-5-oxo-4-propan-2-ylimidazol-1-yl]but-2-enoate

생성물 1

HCID 544453024-[2-(5-Ethyl-2-pyridinyl)-4-methyl-5-oxo-4-propan-2-ylimidazol-1-yl]but-2-enoic acid

출처 및 근거

ORD 기록
ord-feed53de64994928bac4b4f08fce5fa7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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