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Bromide ion → 2-Butoxy-9-(1-tert-butoxycarbonylpiperidin-4-ylmethyl)-8-methoxyadenine

HRID 698661
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HRID 698661 반응식
[Br-:46].[Br:31][CH2:32][CH:33]1[CH2:34][CH2:35][N:36]([C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[CH2:37][CH2:38]1.[C:1](=[O:2])([O-:3])[O-:4].[CH2:14]([CH2:15][CH2:16][CH3:17])[O:18][c:19]1[n:20][c:21]([NH2:30])[c:22]2[n:23][c:24]([O:28][CH3:29])[nH:25][c:26]2[n:27]1.[CH3:47][N:48]([CH3:49])[CH:50]=[O:51].[F:7][C:8]([F:9])([F:10])[C:11]([OH:12])=[O:13].[K+:5].[K+:6].[OH2:52]>>[CH2:14]([CH2:15][CH2:16][CH3:17])[O:18][c:19]1[n:20][c:21]([NH2:30])[c:22]2[n:23][c:24]([O:28][CH3:29])[n:25]([CH2:32][CH:33]3[CH2:34][CH2:35][N:36]([C:39](=[O:40])[O:41][C:42]([CH3:43])([CH3:44])[CH3:45])[CH2:37][CH2:38]3)[c:26]2[n:27]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 259Bromide ionHCID 813Potassium Cation2회HCID 962WaterHCID 6228DimethylformamideHCID 6422Trifluoroacetic acidHCID 19660Carbonate IonHCID 15512811tert-Butyl 4-(bromomethyl)piperidine-1-carboxylate
HCID 57457134
2-(Butyloxy)-8-(methyloxy)-9H-purin-6-amine

생성물 1

HCID 583060912-Butoxy-9-(1-tert-butoxycarbonylpiperidin-4-ylmethyl)-8-methoxyadenine

출처 및 근거

ORD 기록
ord-daf34bcb5b344f989fa149592e3ae6d3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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