1-[4-Amino-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

HCID 359310
ノート反応
部分構造検索類似構造を探す

基本情報

標準SMILES
Cc1cn(C2CC(N)C(CO)O2)c(=O)[nH]c1=O
InChIKey
ADVCGXWUUOVPPB-UHFFFAOYSA-N
分子式
C10H15N3O4
平均分子量
241.24 g/mol

概要

3'-Amino-3'-deoxythimidine is a pyrimidine 2',3'-dideoxyribonucleoside.

名称と識別子

優先名称
1-[4-Amino-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
IUPAC
1-[4-amino-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

名称と別名

3'-Amino-3'-deoxythimidineMFCD00038057SCHEMBL13394196ADVCGXWUUOVPPB-UHFFFAOYSA-NCHEBI:1795821-[4-amino-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dioneNSC-620059LS-13829NS001161741-[4-amino-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dionePyrimidine-2,4(1H,3H)-dione, 1-(4-amino-5-hydroxymethyltetrahydrofur-2-yl)-5-methyl-

データベース識別子

PubChem CID
359310
ChEBI
CHEBI:179582

物性

構造計算による物性

XLogP
-1
極性表面積
105 Ų
水素結合供与体数
3
水素結合受容体数
5
回転可能結合数
2
重原子数
17

化学と産業

薬理情報

Metabolism/Metabolites3p-Amino-3p-deoxythimidine has known human metabolites that include (2S,3S,4S,5R)-4-[[3-Amino-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]-3,5,6-trihydroxyoxane-2-carboxylic acid.
Tissue LocationsKidney
Cellular LocationsCytoplasm

関連反応

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