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Tetrahydrofuran → 2-Benzhydryloxycarbonyl-7-t-butoxycarbonylamino-3-(2-dimethylaminomethyleneamino-thiazol-5-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene

HRID 102350
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HRID 102350 반응식
[CH3:40][O:41][CH:42]([N:43]([CH3:44])[CH3:45])[O:46][CH3:47].[CH3:53][CH2:54][O:55][C:56](=[O:57])[CH3:58].[NH2:1][c:2]1[s:3][c:4]([C:7]2=[C:8]([C:24](=[O:25])[O:26][CH:27]([c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)[N:9]3[C:10](=[O:23])[CH:11]([NH:15][C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH:12]3[S:13][CH2:14]2)[cH:5][n:6]1.[O:48]1[CH2:49][CH2:50][CH2:51][CH2:52]1>>[N:1]([c:2]1[s:3][c:4]([C:7]2=[C:8]([C:24](=[O:25])[O:26][CH:27]([c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[c:34]3[cH:35][cH:36][cH:37][cH:38][cH:39]3)[N:9]3[C:10](=[O:23])[CH:11]([NH:15][C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH:12]3[S:13][CH2:14]2)[cH:5][n:6]1)=[CH:42][N:43]([CH3:44])[CH3:45]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 78373Dimethylformamide dimethyl acetalHCID 131759453-(2-Aminothiazol-5-yl)-2-benzhydryloxycarbonyl-7-t-butoxycarbonylamino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene

생성물 1

HCID 539806132-Benzhydryloxycarbonyl-7-t-butoxycarbonylamino-3-(2-dimethylaminomethyleneamino-thiazol-5-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene

출처 및 근거

ORD 기록
ord-07a2e55bcdbc4fa39bb7418942acbc4f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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