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Hydrochloric Acid → 7-(2,5-Diazabicyclo[2.2.2]oct-2-yl)-1-ethyl-6,8-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid

HRID 2154569
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인쇄 미리보기

반응식

HRID 2154569 반응식
[CH2:1]([CH3:2])[n:3]1[cH:4][c:5]([C:17](=[O:18])[OH:19])[c:6](=[O:16])[c:7]2[cH:8][c:9]([F:15])[c:10]([F:14])[c:11]([F:13])[c:12]12.[CH3:41][C:42]#[N:43].[CH:22]12[NH:23][CH2:24][CH:25]([NH:26][CH2:27]1)[CH2:28][CH2:29]2.[ClH:20].[ClH:21].[N:30]12[CH2:31][CH2:32][CH2:33][N:34]=[C:35]1[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]2>>[CH2:1]([CH3:2])[n:3]1[cH:4][c:5]([C:17](=[O:18])[OH:19])[c:6](=[O:16])[c:7]2[cH:8][c:9]([F:15])[c:10]([N:23]3[CH:22]4[CH2:27][NH:26][CH:25]([CH2:24]3)[CH2:28][CH2:29]4)[c:11]([F:13])[c:12]12
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참가 물질

6

반응물 5

HCID 313Hydrochloric Acid2회HCID 6342AcetonitrileHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 4233472,5-Diazabicyclo(2.2.2)octaneHCID 98351791-Ethyl-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

생성물 1

HCID 13565796
7-(2,5-Diazabicyclo[2.2.2]oct-2-yl)-1-ethyl-6,8-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid

출처 및 근거

ORD 기록
ord-1933abc5aab348e2af6e847a975a1215
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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