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Bicarbonate Ion → N-((1RS,2SR)-2-(3-fluorophenyl)-2-hydroxy-1-((4-(trifluoromethyl)phenyl)methyl)ethyl)-3-phenylpropanamide

HRID 671491
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HRID 671491 반응식
[C:34](=[O:35])([O-:36])[OH:37].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[NH2:1][CH:2]([CH:3]([OH:4])[c:5]1[cH:6][c:7]([F:11])[cH:8][cH:9][cH:10]1)[CH2:12][c:13]1[cH:14][cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]1.[Na+:38].[OH2:45].[c:23]1([CH2:29][CH2:30][C:31](=[O:32])[Cl:33])[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[NH:1]([CH:2]([CH:3]([OH:4])[c:5]1[cH:6][c:7]([F:11])[cH:8][cH:9][cH:10]1)[CH2:12][c:13]1[cH:14][cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]1)[C:31]([CH2:30][CH2:29][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)=[O:32]
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반응물 6

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 962WaterHCID 8857Ethyl AcetateHCID 64801Benzenepropanoyl chlorideHCID 22261501(1RS,2SR)-2-amino-1-(3-fluorophenyl)-3-(4-(trifluoromethyl)phenyl)-1-propanol

생성물 1

HCID 22261551
N-((1RS,2SR)-2-(3-fluorophenyl)-2-hydroxy-1-((4-(trifluoromethyl)phenyl)methyl)ethyl)-3-phenylpropanamide

출처 및 근거

ORD 기록
ord-9d1cf15cc9064115b24de73d04a768d6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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