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Ammonium → tert-butyl 5-(2-[(3-phenyl)phenyl]-6-hydroxy-7-methoxyquinazolin-4-ylamino)-1H-indazole-1-carboxylate

HRID 1214094
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HRID 1214094 반응식
[C:1](=[O:2])([CH3:3])[O:4][c:5]1[cH:6][c:7]2[c:8]([NH:29][c:30]3[cH:31][c:32]4[cH:33][n:34][n:35]([C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[c:36]4[cH:37][cH:38]3)[n:9][c:10](-[c:17]3[cH:18][c:19](-[c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[cH:20][cH:21][cH:22]3)[n:11][c:12]2[cH:13][c:14]1[O:15][CH3:16].[CH3:48][OH:49].[NH4+:47].[OH-:46]>>[OH:4][c:5]1[cH:6][c:7]2[c:8]([NH:29][c:30]3[cH:31][c:32]4[cH:33][n:34][n:35]([C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[c:36]4[cH:37][cH:38]3)[n:9][c:10](-[c:17]3[cH:18][c:19](-[c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[cH:20][cH:21][cH:22]3)[n:11][c:12]2[cH:13][c:14]1[O:15][CH3:16]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 223AmmoniumHCID 887MethanolHCID 961HydroxideHCID 59361986tert-butyl 5-(6-acetoxy-2-[(3-phenyl)phenyl)-7-methoxyquinazolin-4-ylamino)-1H-indazole-1-carboxylate

생성물 1

HCID 59361909tert-butyl 5-(2-[(3-phenyl)phenyl]-6-hydroxy-7-methoxyquinazolin-4-ylamino)-1H-indazole-1-carboxylate

출처 및 근거

ORD 기록
ord-fcadeddfd839468f803da0cc47904f19
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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