Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB03947"
| Predicate | Value (sorted: default) |
|---|---|
| rdfs:label |
"D-Xylulose"
|
| rdf:type | |
| drugbank:description |
"
551-84-8
experimental
Sonoko Takeuchi, Naoto Tonouchi, Kenzo Yokozeki, "Method for producing xylitol or D-xylulose in bacteria." U.S. Patent US6221634, issued May, 1994.
This compound belongs to the pentoses. These are monosaccharides in which the carbohydrate moiety contains five carbon atoms.
Pentoses
Organic Compounds
Organooxygen Compounds
Carbohydrates and Carbohydrate Conjugates
Monosaccharides
Acyloins
Ketones
1,2-Diols
Secondary Alcohols
Enolates
Polyamines
Primary Alcohols
Aldehydes
acyloin
1,2-diol
ketone
polyol
secondary alcohol
primary alcohol
enolate
polyamine
carbonyl group
alcohol
aldehyde
logP
-2.2
ALOGPS
logS
0.65
ALOGPS
Water Solubility
6.78e+02 g/l
ALOGPS
logP
-2.6
ChemAxon
IUPAC Name
(3S,4S)-1,3,4,5-tetrahydroxypentan-2-one
ChemAxon
Traditional IUPAC Name
D-xylulose
ChemAxon
Molecular Weight
150.1299
ChemAxon
Monoisotopic Weight
150.05282343
ChemAxon
SMILES
OC[C@H](O)[C@H](O)C(=O)CO
ChemAxon
Molecular Formula
C5H10O5
ChemAxon
InChI
InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h3,5-8,10H,1-2H2/t3-,5-/m0/s1
ChemAxon
InChIKey
InChIKey=ZAQJHHRNXZUBTE-UCORVYFPSA-N
ChemAxon
Polar Surface Area (PSA)
97.99
ChemAxon
Refractivity
31.6
ChemAxon
Polarizability
13.58
ChemAxon
Rotatable Bond Count
4
ChemAxon
H Bond Acceptor Count
5
ChemAxon
H Bond Donor Count
4
ChemAxon
pKa (strongest acidic)
10.57
ChemAxon
pKa (strongest basic)
-3
ChemAxon
Physiological Charge
0
ChemAxon
Number of Rings
0
ChemAxon
Bioavailability
1
ChemAxon
Rule of Five
true
ChemAxon
ChEBI
17140
PubChem Compound
644111
PubChem Substance
46505615
KEGG Compound
C00310
PDB
XUL
BE0001225
Xylose isomerase
Streptomyces rubiginosus
# Overington JP, Al-Lazikani B, Hopkins AL: How many drug targets are there? Nat Rev Drug Discov. 2006 Dec;5(12):993-6. "Pubmed":http://www.ncbi.nlm.nih.gov/pubmed/17139284
# Imming P, Sinning C, Meyer A: Drugs, their targets and the nature and number of drug targets. Nat Rev Drug Discov. 2006 Oct;5(10):821-34. "Pubmed":http://www.ncbi.nlm.nih.gov/pubmed/17016423
unknown
Xylose isomerase
Carbohydrate transport and metabolism
Involved in D-xylose catabolism
xylA
Cytoplasm
None
4.78
43228.0
Streptomyces rubiginosus
GenBank Gene Database
M73789
GenBank Protein Database
153534
UniProtKB
P24300
UniProt Accession
XYLA_STRRU
EC 5.3.1.5
>Xylose isomerase
MNYQPTPEDRFTFGLWTVGWQGRDPFGDATRRALDPVESVRRLAELGAHGVTFHDDDLIP
FGSSDSEREEHVKRFRQALDDTGMKVPMATTNLFTHPVFKDGGFTANDRDVRRYALRKTI
RNIDLAVELGAETYVAWGGREGAESGGAKDVRDALDRMKEAFDLLGEYVTSQGYDIRFAI
EPKPNEPRGDILLPTVGHALAFIERLERPELYGVNPEVGHEQMAGLNFPHGIAQALWAGK
LFHIDLNGQNGIKYDQDLRFGAGDLRAAFWLVDLLESAGYSGPRHFDFKPPRTEDFDGVW
ASAAGCMRNYLILKERAAAFRADPEVQEALRASRLDELARPTAADGLQALLDDRSAFEEF
DVDAAAARGMAFERLDQLAMDHLLGARG
>1167 bp
ATGAACTACCAGCCCACCCCCGAGGACAGGTTCACCTTCGGACTGTGGACCGTCGGCTGG
CAGGGACGGGACCCCTTCGGTGACGCCACGCGGCGCGCCCTCGACCCGGTCGAGTCGGTG
CGGCGGCTGGCCGAGCTGGGCGCCCACGGCGTCACGTTCCACGACGACGACCTCATCCCC
TTCGGCTCCAGCGACAGCGAGCGCGAGGAGCACGTCAAGCGGTTCCGGCAGGCGCTGGAC
GACACCGGCATGAAGGTGCCGATGGCCACCACCAACCTGTTCACCCACCCGGTGTTCAAG
GACGGCGGCTTCACCGCCAACGACCGCGACGTGCGCCGCTACGCCCTGCGCAAGACCATC
CGCAACATCGACCTCGCGGTCGAGCTCGGCGCCGAGACCTATGTGGCCTGGGGCGGCCGC
GAGGGTGCCGAGTCGGGTGGCGCCAAGGACGTGCGGGACGCCCTCGACCGCATGAAGGAG
GCCTTCGACCTGCTCGGCGAGTACGTCACCTCCCAGGGCTACGACATCCGCTTCGCCATC
GAGCCCAAGCCGAACGAGCCGCGCGGCGACATCCTGCTCCCCACCGTCGGCCACGCCCTG
GCGTTCATCGAGCGCCTGGAGCGACCGGAGCTGTACGGCGTGAACCCCGAGGTCGGCCAC
GAGCAGATGGCCGGGCTGAACTTCCCGCACGGCATCGCGCAGGCGCTGTGGGCGGGCAAG
CTGTTCCACATCGACCTCAACGGCCAGAACGGCATCAAGTACGACCAGGACCTCCGCTTC
GGCGCGGGCGACCTGCGGGCCGCGTTCTGGCTGGTGGACCTGCTGGAGTCGGCCGGCTAC
AGCGGCCCGCGGCACTTCGACTTCAAGCCGCCGCGGACCGAGGACTTCGACGGGGTGTGG
GCCTCGGCGGCCGGCTGCATGCGCAACTACCTGATCCTCAAGGAGCGTGCGGCGGCCTTC
CGCGCCGACCCCGAGGTGCAGGAGGCGCTGCGCGCGTCCCGTCTGGACGAGCTGGCCCGG
CCCACGGCGGCCGACGGTCTGCAGGCCCTGCTCGACGACCGGTCCGCCTTCGAGGAGTTC
GACGTCGACGCGGCGGCGGCCCGTGGGATGGCCTTCGAGCGCCTGGACCAGCTGGCGATG
GACCACCTGCTGGGCGCCCGGGGCTGA
PF01261
AP_endonuc_2
function
isomerase activity
function
intramolecular oxidoreductase activity
function
intramolecular oxidoreductase activity, interconverting aldoses and ketoses
function
xylose isomerase activity
function
catalytic activity
process
metabolism
process
macromolecule metabolism
process
carbohydrate metabolism
process
physiological process
"
|
| owl:sameAs |
All properties reside in the graph file:///home/swish/src/ClioPatria/guidelines3/drugbank_small.nt
The resource does not appear as an object