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Potassium Cation → Phenylmethyl 3-{[6-amino-2-(butyloxy)-8-(methyloxy)-9H-purin-9-yl]methyl}-1-piperidinecarboxylate

HRID 100132
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HRID 100132 반응식
[Br:31][CH2:32][CH:33]1[CH2:34][N:35]([C:39](=[O:40])[O:41][CH2:42][c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[CH2:36][CH2:37][CH2:38]1.[C:25](=[O:26])([O-:27])[O-:28].[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[n:7][c:8]([NH2:17])[c:9]2[n:10][c:11]([O:15][CH3:16])[nH:12][c:13]2[n:14]1.[K+:29].[K+:30].[O-:18][C:19]([C:20]([F:21])([F:22])[F:23])=[O:24].[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[OH2:54]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[n:7][c:8]([NH2:17])[c:9]2[n:10][c:11]([O:15][CH3:16])[n:12]([CH2:32][CH:33]3[CH2:34][N:35]([C:39](=[O:40])[O:41][CH2:42][c:43]4[cH:44][cH:45][cH:46][cH:47][cH:48]4)[CH2:36][CH2:37][CH2:38]3)[c:13]2[n:14]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 813Potassium Cation2회HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 84468TrifluoroacetateHCID 23000675Benzyl 3-(bromomethyl)piperidine-1-carboxylateHCID 574571342-(Butyloxy)-8-(methyloxy)-9H-purin-6-amine

생성물

1
HCID 58306120Phenylmethyl 3-{[6-amino-2-(butyloxy)-8-(methyloxy)-9H-purin-9-yl]methyl}-1-piperidinecarboxylate

출처 및 근거

ORD 기록
ord-472dfb218c5440229c8a1cb2835b3f5b
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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