Trifluoroacetic acid → 1,4,7,8,9,10-Hexahydro-9-(4-piperidinyl carbonyl)pyrido[3,4-f]quinoxaline-2,3-dione

반응식

[O:1]=[c:2]1[c:3](=[O:31])[nH:4][c:5]2[cH:6][cH:7][c:8]3[c:9]([c:10]2[nH:11]1)[CH2:12][N:13]([C:16](=[O:17])[CH:18]1[CH2:19][CH2:20][N:21]([C:24]([O:25][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:30])[CH2:22][CH2:23]1)[CH2:14][CH2:15]3.[OH:32][C:33]([C:34]([F:35])([F:36])[F:37])=[O:38]>>[O:1]=[c:2]1[c:3](=[O:31])[nH:4][c:5]2[cH:6][cH:7][c:8]3[c:9]([c:10]2[nH:11]1)[CH2:12][N:13]([C:16](=[O:17])[CH:18]1[CH2:19][CH2:20][NH:21][CH2:22][CH2:23]1)[CH2:14][CH2:15]3

참가 물질

반응물 2

HCID 6422Trifluoroacetic acid

HCID 212530551,1-Dimethylethyl 4-[(1,2,3,4,7,8,9,10-octahydro-2,3-dioxopyrido[3,4-f]quinoxaline-9-yl)carbonyl]-1-piperidine carboxylate

생성물 1

HCID 212530561,4,7,8,9,10-Hexahydro-9-(4-piperidinyl carbonyl)pyrido[3,4-f]quinoxaline-2,3-dione

출처 및 근거

ORD 기록: ord-cbdb515bf4cf45368f2c42026830bb29
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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