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Acetate → N-[6-(3,3-dimethylbutylamino)-3-hydroxy-5-methyl-6-oxo-1-phenylhexan-2-yl]-3-(2-oxopyrrolidin-1-yl)-5-phenoxybenzamide

HRID 167290
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HRID 167290 반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]([CH:9]([CH2:10][CH:11]([CH3:12])[C:13]([NH:14][CH2:15][CH2:16][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:21])[OH:22])[NH:23][C:24]([c:25]1[cH:26][c:27]([OH:37])[cH:28][c:29]([N:31]2[C:32](=[O:36])[CH2:33][CH2:34][CH2:35]2)[cH:30]1)=[O:38].[CH3:48][C:49](=[O:50])[O-:51].[CH3:52][CH2:53][N:54]([CH2:55][CH3:56])[CH2:57][CH3:58].[Cl:59][CH2:60][Cl:61].[c:39]1([B:45]([OH:46])[OH:47])[cH:40][cH:41][cH:42][cH:43][cH:44]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH:8]([CH:9]([CH2:10][CH:11]([CH3:12])[C:13]([NH:14][CH2:15][CH2:16][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:21])[OH:22])[NH:23][C:24]([c:25]1[cH:26][c:27]([O:37][c:39]2[cH:40][cH:41][cH:42][cH:43][cH:44]2)[cH:28][c:29]([N:31]2[C:32](=[O:36])[CH2:33][CH2:34][CH2:35]2)[cH:30]1)=[O:38]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 175AcetateHCID 6344DichloromethaneHCID 8471TriethylamineHCID 66827Phenylboronic AcidHCID 22253058N-[6-(3,3-dimethylbutylamino)-3-hydroxy-5-methyl-6-oxo-1-phenylhexan-2-yl]-3-hydroxy-5-(2-oxopyrrolidin-1-yl)benzamide

생성물 1

HCID 22253062
N-[6-(3,3-dimethylbutylamino)-3-hydroxy-5-methyl-6-oxo-1-phenylhexan-2-yl]-3-(2-oxopyrrolidin-1-yl)-5-phenoxybenzamide

출처 및 근거

ORD 기록
ord-087b4aff8a6f4a4fa7b75371979e40d8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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