Ethylenediamine → N-(2-aminoethyl)-6-(2,2-diphenylethylamino)-9-[5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purine-2-carboxamide

반응식

[CH2:41]([CH2:42][NH2:43])[NH2:44].[Cl:45][CH2:46][Cl:47].[c:1]1([CH:7]([CH2:8][NH:9][c:10]2[c:11]3[n:12][cH:13][n:14]([CH:23]4[O:24][CH:25]([C:30](=[O:31])[NH:32][CH2:33][CH3:34])[CH:26]([OH:29])[CH:27]4[OH:28])[c:15]3[n:16][c:17]([C:19](=[O:20])[NH:21][CH3:22])[n:18]2)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([CH2:8][NH:9][c:10]2[c:11]3[n:12][cH:13][n:14]([CH:23]4[O:24][CH:25]([C:30](=[O:31])[NH:32][CH2:33][CH3:34])[CH:26]([OH:29])[CH:27]4[OH:28])[c:15]3[n:16][c:17]([C:19](=[O:20])[NH:21][CH2:22][CH2:42][NH2:43])[n:18]2)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

참가 물질

반응물 3

HCID 3301Ethylenediamine

HCID 6344Dichloromethane

HCID 178464990HCID 178464990, 화합물

생성물 1

HCID 178464989N-(2-aminoethyl)-6-(2,2-diphenylethylamino)-9-[5-(ethylcarbamoyl)-3,4-dihydroxyoxolan-2-yl]purine-2-carboxamide

출처 및 근거

ORD 기록: ord-f6a3090b4fe94666b7aac19557ab0876
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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