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Sodium Ion → HCID 178446905, 화합물

HRID 1234812
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HRID 1234812 반응식
[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([O:21][CH2:22][C:23]([CH3:24])([CH3:25])[CH3:26])[cH:13][c:14]1[C:15]21[N:16]=[C:17]([NH2:20])[O:18][CH2:19]1.[C:50]([O:51][Pd:52][CH2:53][c:54]1[cH:55][cH:56][cH:57][cH:58][c:59]1[P:60]([c:61]1[cH:62][cH:63][cH:64][cH:65][c:66]1[CH3:67])[c:68]1[cH:69][cH:70][cH:71][cH:72][c:73]1[CH3:74])(=[O:75])[CH3:76].[CH2:37]1[O:38][CH2:39][CH2:40][O:41][CH2:42]1.[CH3:43][CH2:44][O:45][C:46]([CH3:47])=[O:48].[CH:33]1([NH2:36])[CH2:34][CH2:35]1.[Na+:27].[Na+:28].[O-:29][C:30]([O-:31])=[O:32].[OH2:49]>>[c:2]1([C:30](=[O:32])[NH:36][CH:33]2[CH2:34][CH2:35]2)[cH:3][c:4]2[c:5]([cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([O:21][CH2:22][C:23]([CH3:24])([CH3:25])[CH3:26])[cH:13][c:14]1[C:15]21[N:16]=[C:17]([NH2:20])[O:18][CH2:19]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 923Sodium Ion2회HCID 962WaterHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 69828CyclopropylamineHCID 584662982'-bromo-7'-(2,2-dimethylpropoxy)spiro[5H-1,3-oxazole-4,9'-xanthene]-2-amine
HCID 178476741
HCID 178476741, 화합물

생성물 1

HCID 178446905HCID 178446905, 화합물

출처 및 근거

ORD 기록
ord-38cb7a19e07442a392c776f79314a496
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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