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Hydrochloric Acid → 7-cyclopentyl-2-{5-[4-(2-dimethylamino-acetyl)-piperazin-1-yl]-pyridin-2-ylamino}-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid dimethylamide

HRID 801212
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HRID 801212 반응식
[B-:50]([F:51])([F:52])([F:53])[F:54].[CH3:2][N:3]([C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:9]([n:10][c:11]([NH:14][c:15]3[n:16][cH:17][c:18]([N:21]4[CH2:22][CH2:23][NH:24][CH2:25][CH2:26]4)[cH:19][cH:20]3)[n:12][cH:13]2)[n:27]1[CH:28]1[CH2:29][CH2:30][CH2:31][CH2:32]1)[CH3:33].[CH3:34][N:35]([CH3:36])[CH2:37][C:38]([OH:39])=[O:40].[CH3:77][OH:78].[CH:41]([N:42]([CH:43]([CH3:44])[CH3:45])[CH2:46][CH3:47])([CH3:48])[CH3:49].[ClH:1].[O:72]=[CH:73][N:74]([CH3:75])[CH3:76].[n:55]1([O:56][C:57]([N:58]([CH3:59])[CH3:60])=[N+:61]([CH3:62])[CH3:63])[c:64]2[cH:65][cH:66][cH:67][cH:68][c:69]2[n:70][n:71]1>>[CH3:2][N:3]([C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:9]([n:10][c:11]([NH:14][c:15]3[n:16][cH:17][c:18]([N:21]4[CH2:22][CH2:23][N:24]([C:38]([CH2:37][N:35]([CH3:34])[CH3:36])=[O:39])[CH2:25][CH2:26]4)[cH:19][cH:20]3)[n:12][cH:13]2)[n:27]1[CH:28]1[CH2:29][CH2:30][CH2:31][CH2:32]1)[CH3:33]
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 313Hydrochloric AcidHCID 673N,N-DimethylglycineHCID 887MethanolHCID 6228DimethylformamideHCID 26255TetrafluoroborateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluronium
HCID 44631912
Ribociclib

생성물 1

HCID 448196487-cyclopentyl-2-{5-[4-(2-dimethylamino-acetyl)-piperazin-1-yl]-pyridin-2-ylamino}-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid dimethylamide

출처 및 근거

ORD 기록
ord-b8a35a6fb9d44e91a5fa74f731f7cfc3
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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