5-fluoro-1-[(4R,6R)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidine-2,4-dione

HCID 200831CAS 2797-17-3

基本情報

標準SMILES
CC1(C)OC2C(O1)[C@@H](CO)O[C@H]2n1cc(F)c(=O)[nH]c1=O
InChIKey
LHTMLCXJMYPWGR-NPDIDSPYSA-N
分子式
C12H15FN2O6
平均分子量
302.26 g/mol
単同位体質量
302.09141442

名称と識別子

優先名称
5-fluoro-1-[(4R,6R)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidine-2,4-dione
IUPAC
5-fluoro-1-[(4R,6R)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidine-2,4-dione

名称と別名

2',3'-O-Isopropylidene-5-fluorouridine2797-17-35-fluoro-1-[(4R,6R)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidine-2,4-dioneBRN 08954085-Fluoro-2',3'-O-(1-methylethylidene)uridineUridine, 5-fluoro-2',3'-O-(1-methylethylidene)-DTXSID20950659LHTMLCXJMYPWGR-NPDIDSPYSA-NE880435-Fluoro-4-hydroxy-1-[2,3-O-(1-methylethylidene)pentofuranosyl]pyrimidin-2(1H)-one5-Fluoro-4-hydroxy-1-[2,3-O-(1-methylethylidene)-beta-D-glycero-pentofuranosyl]pyrimidin-2(1H)-one

データベース識別子

CAS
2797-17-3
PubChem CID
200831
DTXSID
DTXSID20950659

物性

構造計算による物性

XLogP
-1
極性表面積
97.3 Ų
水素結合供与体数
2
水素結合受容体数
7
回転可能結合数
2
重原子数
21

関連反応

3 件

関連ノート

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