Home > Compound List > Compound details
82494-09-5 molecular structure
click picture or here to close

(2R,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6R)-6-(decyloxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

ChemBase ID: 132378
Molecular Formular: C22H42O11
Molecular Mass: 482.56228
Monoisotopic Mass: 482.27271216
SMILES and InChIs

SMILES:
CCCCCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)O
Canonical SMILES:
CCCCCCCCCCO[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O[C@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O
InChI:
InChI=1S/C22H42O11/c1-2-3-4-5-6-7-8-9-10-30-21-19(29)17(27)20(14(12-24)32-21)33-22-18(28)16(26)15(25)13(11-23)31-22/h13-29H,2-12H2,1H3/t13-,14-,15-,16+,17-,18-,19-,20-,21-,22-/m1/s1
InChIKey:
WOQQAWHSKSSAGF-WXFJLFHKSA-N

Cite this record

CBID:132378 http://www.chembase.cn/molecule-132378.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2R,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6R)-6-(decyloxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
IUPAC Traditional name
(2R,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R,6R)-6-(decyloxy)-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Synonyms
Decyl-β-D-maltoside
Decyl β-D-maltopyranoside
Decyl-β-D-maltoside solution
Detergent Screening Solution 24/Fluka kit no 66317
Decyl-β-D-maltoside 10 mM solution
CAS Number
82494-09-5
EC Number
231-791-2
MDL Number
MFCD00061624
Beilstein Number
4923334
PubChem SID
24894148
24846072
162226655
PubChem CID
5288728

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 5288728 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 11.939976  H Acceptors 11 
H Donor LogD (pH = 5.5) -0.06893751 
LogD (pH = 7.4) -0.06894987  Log P -0.068937354 
Molar Refractivity 114.5675 cm3 Polarizability 47.13863 Å3
Polar Surface Area 178.53 Å2 Rotatable Bonds 14 
Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
H2O: soluble50 mg/mL, clear expand Show data source
Optical Rotation
[α]20/D +51.5±3°, c = 1% in H2O expand Show data source
Critical Micelle Concentration
1.6 mM(20-25°C) expand Show data source
1.6-1.8 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
German water hazard class
2 expand Show data source
3 expand Show data source
Personal Protective Equipment
Eyeshields, Gloves expand Show data source
Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter expand Show data source
Storage Temperature
-20°C expand Show data source
2-8°C expand Show data source
Purity
≥98% (GC) expand Show data source
≥98.0% (TLC) expand Show data source
Description
non-ionic expand Show data source
Empirical Formula (Hill Notation)
C22H42O11 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 30715 external link
Other Notes
Suitable detergent for studies on delipidated beef heart cytochrome c oxidase activity1

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle