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Sodium Ion → HCID 178435793, 화합물

HRID 146979
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HRID 146979 반응식
[Br:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH3:9])[N:10]2[C:11](=[O:27])[O:12][C:13]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)([CH2:22][C:23]([CH3:24])([CH3:25])[OH:26])[CH2:14][CH2:15]2)[cH:6][cH:7]1.[C:47](=[O:48])([O-:49])[O-:50].[N+:28](=[O:29])([O-:30])[c:31]1[c:32]([NH2:46])[cH:33][cH:34][c:35]([B:37]2[O:38][C:39]([CH3:40])([CH3:41])[C:42]([CH3:43])([CH3:44])[O:45]2)[cH:36]1.[Na+:51].[Na+:52].[OH2:53]>>[c:2]1(-[c:35]2[cH:34][cH:33][c:32]([NH2:46])[c:31]([N+:28](=[O:29])[O-:30])[cH:36]2)[cH:3][cH:4][c:5]([CH:8]([CH3:9])[N:10]2[C:11](=[O:27])[O:12][C:13]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)([CH2:22][C:23]([CH3:24])([CH3:25])[OH:26])[CH2:14][CH2:15]2)[cH:6][cH:7]1
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반응물 5

HCID 923Sodium Ion2회HCID 962WaterHCID 19660Carbonate IonHCID 162179142-Nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)anilineHCID 668698253-[1-(4-Bromophenyl)ethyl]-6-(2-hydroxy-2-methylpropyl)-6-phenyl-1,3-oxazinan-2-one

생성물 1

HCID 178435793HCID 178435793, 화합물

출처 및 근거

ORD 기록
ord-8882c53ce9414fe1b3598acca83aa8d1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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