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Calcium Cation → 1-ethyl-7-methyl-3-(4-{[tris(1-methylethyl)silyl]oxy}phenyl)-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one

HRID 312471
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인쇄 미리보기

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HRID 312471 반응식
[CH2:12]([CH3:13])[n:14]1[c:15](=[O:31])[n:16](-[c:24]2[cH:25][cH:26][c:27]([OH:30])[cH:28][cH:29]2)[c:17]2[n:18][cH:19][cH:20][c:21]([CH3:23])[c:22]12.[CH:1]([CH3:2])([CH3:3])[Si:4]([CH:5]([CH3:6])[CH3:7])([CH:8]([CH3:9])[CH3:10])[Cl:11].[Ca+2:35].[Cl-:34].[Cl-:36].[H-:33].[Na+:32].[Na+:41].[O-:37][C:38]([OH:39])=[O:40].[O:42]=[CH:43][N:44]([CH3:45])[CH3:46]>>[CH:1]([CH3:2])([CH3:3])[Si:4]([CH:5]([CH3:6])[CH3:7])([CH:8]([CH3:9])[CH3:10])[O:30][c:27]1[cH:26][cH:25][c:24](-[n:16]2[c:15](=[O:31])[n:14]([CH2:12][CH3:13])[c:22]3[c:17]2[n:18][cH:19][cH:20][c:21]3[CH3:23])[cH:29][cH:28]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 271Calcium CationHCID 312Chloride2회HCID 769Bicarbonate IonHCID 923Sodium Ion2회HCID 6228DimethylformamideHCID 139400Triisopropylsilyl chlorideHCID 166653Hydride
HCID 58577432
HCID 58577432, 화합물

생성물 1

HCID 585775691-ethyl-7-methyl-3-(4-{[tris(1-methylethyl)silyl]oxy}phenyl)-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one

출처 및 근거

ORD 기록
ord-6ce605a14c9744fd957ace82db477adc
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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