Dimethyl Sulfoxide → 6-[7-(Ethoxymethyl)-8-(2-hydroxyethylamino)-3-methyl-2,6-dioxopurin-1-yl]hexan-2-yl acetate

反応式

[C:1]([CH3:2])(=[O:3])[O:4][CH:5]([CH2:6][CH2:7][CH2:8][CH2:9][n:10]1[c:11](=[O:12])[n:13]([CH3:26])[c:14]2[n:15][c:16]([Br:25])[n:17]([CH2:21][O:22][CH2:23][CH3:24])[c:18]2[c:19]1=[O:20])[CH3:27].[CH3:32][S:33]([CH3:34])=[O:35].[NH2:28][CH2:29][CH2:30][OH:31]>>[C:1]([CH3:2])(=[O:3])[O:4][CH:5]([CH2:6][CH2:7][CH2:8][CH2:9][n:10]1[c:11](=[O:12])[n:13]([CH3:26])[c:14]2[n:15][c:16]([NH:28][CH2:29][CH2:30][OH:31])[n:17]([CH2:21][O:22][CH2:23][CH3:24])[c:18]2[c:19]1=[O:20])[CH3:27]

参加物

反応物 3

HCID 679Dimethyl Sulfoxide

HCID 700Ethanolamine

HCID 224990556-[8-Bromo-7-(ethoxymethyl)-3-methyl-2,6-dioxopurin-1-yl]hexan-2-yl acetate

生成物 1

HCID 185069646-[7-(Ethoxymethyl)-8-(2-hydroxyethylamino)-3-methyl-2,6-dioxopurin-1-yl]hexan-2-yl acetate

出典と根拠

ORDレコード: ord-8220aa9220004ba6bef13029fbe48bb4
出典データセット: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

反応ノート

読み込み中…