Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB07923"
| Predicate | Value (sorted: none) |
|---|---|
| ns1:description |
"
experimental
This compound belongs to the alkyl glycosides. These are lipids containing a glycosyl moiety (one or several units) linked to the hydroxyl group of a fatty alcohol.
Alkyl Glycosides
Organic Compounds
Lipids
Alkyl Glycosides
O-glycosyl Compounds
Hexoses
Oxanes
Secondary Alcohols
1,2-Diols
Primary Alcohols
Acetals
Polyamines
oxane
saccharide
monosaccharide
polyol
secondary alcohol
1,2-diol
primary alcohol
polyamine
acetal
ether
alcohol
logP
1.13
ALOGPS
logS
-1.3
ALOGPS
Water Solubility
1.60e+01 g/l
ALOGPS
logP
0.81
ChemAxon
IUPAC Name
(2S,3R,4S,5R,6R)-2-(hydroxymethyl)-6-(octyloxy)oxane-3,4,5-triol
ChemAxon
Traditional IUPAC Name
(2S,3R,4S,5R,6R)-2-(hydroxymethyl)-6-(octyloxy)oxane-3,4,5-triol
ChemAxon
Molecular Weight
292.3685
ChemAxon
Monoisotopic Weight
292.188588628
ChemAxon
SMILES
[H][C@]1(O)[C@@]([H])(O)[C@]([H])(CO)O[C@@]([H])(OCCCCCCCC)[C@]1([H])O
ChemAxon
Molecular Formula
C14H28O6
ChemAxon
InChI
InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11-,12-,13+,14+/m0/s1
ChemAxon
InChIKey
InChIKey=HEGSGKPQLMEBJL-QSLWVIQJSA-N
ChemAxon
Polar Surface Area (PSA)
99.38
ChemAxon
Refractivity
72.95
ChemAxon
Polarizability
32.57
ChemAxon
Rotatable Bond Count
9
ChemAxon
H Bond Acceptor Count
6
ChemAxon
H Bond Donor Count
4
ChemAxon
pKa (strongest acidic)
12.21
ChemAxon
pKa (strongest basic)
-3
ChemAxon
Physiological Charge
0
ChemAxon
Number of Rings
1
ChemAxon
Bioavailability
1
ChemAxon
Rule of Five
true
ChemAxon
Ghose Filter
true
ChemAxon
PubChem Compound
46937109
PubChem Substance
99444394
PDB
HSG
BE0003818
Aquaporin Z
Escherichia coli (strain K12)
# Berman HM, Westbrook J, Feng Z, Gilliland G, Bhat TN, Weissig H, Shindyalov IN, Bourne PE: The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42. "Pubmed":http://www.ncbi.nlm.nih.gov/pubmed/10592235
unknown
Aquaporin Z
Carbohydrate transport and metabolism
Channel that permits osmotically driven movement of water in both directions. It is involved in the osmoregulation and in the maintenance of cell turgor during volume expansion in rapidly growing cells. It mediates rapid entry or exit of water in response to abrupt changes in osmolarity
aqpZ
Cell inner membrane
9-29
34-54
82-102
131-151
156-176
202-222
7.63
23702.6
Escherichia coli (strain K12)
GeneCards
aqpZ
GenBank Gene Database
U38664
GenBank Protein Database
1051283
UniProtKB
P60844
UniProt Accession
AQPZ_ECOLI
Bacterial nodulin-like intrinsic protein
>Aquaporin Z
MFRKLAAECFGTFWLVFGGCGSAVLAAGFPELGIGFAGVALAFGLTVLTMAFAVGHISGG
HFNPAVTIGLWAGGRFPAKEVVGYVIAQVVGGIVAAALLYLIASGKTGFDAAASGFASNG
YGEHSPGGYSMLSALVVELVLSAGFLLVIHGATDKFAPAGFAPIAIGLALTLIHLISIPV
TNTSVNPARSTAVAIFQGGWALEQLWFFWVVPIVGGIIGGLIYRTLLEKRD
PF00230
MIP
component
cell
component
intrinsic to membrane
component
integral to membrane
component
membrane
function
transporter activity
process
physiological process
process
cellular physiological process
process
transport
"
|
| rdf:type | |
| rdfs:label |
"octyl alpha-L-altropyranoside"
|
All properties reside in the graph file:///home/swish/src/ClioPatria/guidelines/drugbank_small.nt
The resource does not appear as an object