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Acetone → HCID 178520243, 화합물

HRID 805650
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HRID 805650 반응식
[CH3:29][Si:30]([NH:31][C:32](=[O:33])[C:34]([F:35])([F:36])[F:37])([CH3:38])[CH3:39].[CH3:83][C:84](=[O:85])[CH3:86].[Cl:1][c:2]1[c:3]([N:20]2[CH2:21][CH:22]3[CH2:23][CH2:24][CH2:25][NH:26][CH:27]3[CH2:28]2)[c:4]([F:19])[cH:5][c:6]2[c:7](=[O:18])[c:8]([C:15](=[O:16])[OH:17])[cH:9][n:10]([CH:12]3[CH2:13][CH2:14]3)[c:11]12.[Cl:40][CH2:41][C:42]1=[C:43]([C:61](=[O:62])[O:63][CH:64]([c:65]2[cH:66][cH:67][cH:68][cH:69][cH:70]2)[c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)[N:44]2[C:45](=[O:60])[CH:46]([NH:50][C:51]([CH2:52][c:53]3[cH:54][cH:55][cH:56][cH:57][cH:58]3)=[O:59])[CH:47]2[S:48][CH2:49]1.[Cl:80][CH2:81][Cl:82].[ClH:79].[I-:77].[Na+:78].[OH2:87]>>[Cl:1][c:2]1[c:3]([N:20]2[CH2:21][CH:22]3[CH2:23][CH2:24][CH2:25][N:26]([CH2:41][C:42]4=[C:43]([C:61](=[O:62])[O:63][CH:64]([c:65]5[cH:66][cH:67][cH:68][cH:69][cH:70]5)[c:71]5[cH:72][cH:73][cH:74][cH:75][cH:76]5)[N:44]5[C:45](=[O:60])[CH:46]([NH:50][C:51]([CH2:52][c:53]6[cH:54][cH:55][cH:56][cH:57][cH:58]6)=[O:59])[CH:47]5[S:48][CH2:49]4)[CH:27]3[CH2:28]2)[c:4]([F:19])[cH:5][c:6]2[c:7](=[O:18])[c:8]([C:15](=[O:16])[OH:17])[cH:9][n:10]([CH:12]3[CH2:13][CH2:14]3)[c:11]12
참가 물질출처 및 근거반응 노트

참가 물질

10

반응물 9

HCID 180AcetoneHCID 313Hydrochloric AcidHCID 923Sodium IonHCID 962WaterHCID 6344DichloromethaneHCID 30165Iodide IonHCID 555527Acetamide, 2,2,2-trifluoro-N-(trimethylsilyl)-
HCID 5271843
3-Quinolinecarboxylic acid, 8-chloro-1-cyclopropyl-6-fluoro-1,4-dihydro-7-(octahydro-6H-pyrrolo(3,4-b)pyridin-6-yl)-4-oxo-
HCID 13180402HCID 13180402, 화합물

생성물 1

HCID 178520243HCID 178520243, 화합물

출처 및 근거

ORD 기록
ord-84323956a9ed48cdadbcb29f890cc516
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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