Trifluoroacetic acid → Trifluoroacetic acid

반응식

[C:8]([O:9][C:10](=[O:11])[N:15]1[CH2:16][CH:17]([NH:19][C:20]([CH2:21][NH:22][c:23]2[n:24][n:25]([CH3:36])[c:26]3[cH:27][cH:28][c:29]([C:32]([F:33])([F:34])[F:35])[cH:30][c:31]23)=[O:37])[CH2:18]1)([CH3:12])([CH3:13])[CH3:14].[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7]>>[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7].[NH:15]1[CH2:16][CH:17]([NH:19][C:20]([CH2:21][NH:22][c:23]2[n:24][n:25]([CH3:36])[c:26]3[cH:27][cH:28][c:29]([C:32]([F:33])([F:34])[F:35])[cH:30][c:31]23)=[O:37])[CH2:18]1

참가 물질

반응물 2

HCID 6422Trifluoroacetic acid

HCID 674791243-[2-(1-Methyl-5-trifluoromethyl-1H-indazol-3-ylamino)-acetylamino]-azetidine-1-carboxylic acid tert-butyl ester

생성물 2

HCID 6422Trifluoroacetic acid

HCID 67478756N-(azetidin-3-yl)-2-[[1-methyl-5-(trifluoromethyl)indazol-3-yl]amino]acetamide

출처 및 근거

ORD 기록: ord-890a473ec0bb42569793c2a33c3eba9f
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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