Hex-2-ulofuranosyl hexopyranoside

HCID 1115CAS 57-50-1

基本情報

標準SMILES
OCC1OC(OC2(CO)OC(CO)C(O)C2O)C(O)C(O)C1O
InChIKey
CZMRCDWAGMRECN-UHFFFAOYSA-N
分子式
C12H22O11
平均分子量
342.3 g/mol
単同位体質量
342.11621152

概要

2-{[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol is a glycoside.

名称と識別子

優先名称
Hex-2-ulofuranosyl hexopyranoside
IUPAC
2-[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

名称と別名

Hex-2-ulofuranosyl hexopyranoside2-[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol2-(3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triolGlyTouCan:G70561XMRefChem:1048311CHEBI:87442G70561XM1192061-43-0.alpha.-D-Glucopyranoside, .beta.-D-fructofuranosylBETA-D-FRUCTOFURANOSYL-ALPHA-D-GALACTOPYRANOSIDE3h-sucrosealpha-D-Glc-(1-->2)-beta-D-Fru
名称をさらに表示
13322-96-82-{[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolZuckerSucrose,ultrapureb-D-Fructofuranosyl-a-D-galactopyranoside(.alpha.-D-Glucosido)-.beta.-D-fructofuranoside.alpha.-D-Glucopyranosyl .beta.-D-fructofuranoside.beta.-D-Fructofuranoside, .alpha.-D-glucopyranosyl

データベース識別子

CAS
57-50-1
PubChem CID
1115
DTXSID
DTXSID301355853
ChEBI
CHEBI:193884

物性

構造計算による物性

XLogP
-3.7
極性表面積
190 Ų
水素結合供与体数
8
水素結合受容体数
11
回転可能結合数
5
重原子数
23

実験および物理化学的性質

Collision Cross Section172.1 Ų [M+Na-H2O]+ [CCS Type: DT; Method: stepped-field]

関連反応

12 件

関連ノート

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