Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB03242"
| Predicate | Value (sorted: default) |
|---|---|
| rdfs:label |
"P-Aminophenyl-Alpha-D-Galactopyranoside"
|
| rdf:type | |
| drugbank:description |
"
experimental
This compound belongs to the o-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond.
O-glycosyl Compounds
Organic Compounds
Organooxygen Compounds
Carbohydrates and Carbohydrate Conjugates
Glycosyl Compounds
Hexoses
Phenol Ethers
Alkyl Aryl Ethers
Anilines
Primary Aromatic Amines
Oxanes
Secondary Alcohols
1,2-Diols
Primary Alcohols
Acetals
Polyamines
phenol ether
aniline
alkyl aryl ether
benzene
primary aromatic amine
oxane
monosaccharide
polyol
secondary alcohol
1,2-diol
acetal
primary alcohol
polyamine
ether
amine
primary amine
alcohol
organonitrogen compound
logP
-1.2
ALOGPS
logS
-0.92
ALOGPS
Water Solubility
3.29e+01 g/l
ALOGPS
logP
-1.4
ChemAxon
IUPAC Name
(2S,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
ChemAxon
Traditional IUPAC Name
(2S,3R,4S,5S,6R)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
ChemAxon
Molecular Weight
271.2665
ChemAxon
Monoisotopic Weight
271.105587281
ChemAxon
SMILES
NC1=CC=C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1
ChemAxon
Molecular Formula
C12H17NO6
ChemAxon
InChI
InChI=1S/C12H17NO6/c13-6-1-3-7(4-2-6)18-12-11(17)10(16)9(15)8(5-14)19-12/h1-4,8-12,14-17H,5,13H2/t8-,9-,10+,11-,12-/m1/s1
ChemAxon
InChIKey
InChIKey=MIAKOEWBCMPCQR-RMPHRYRLSA-N
ChemAxon
Polar Surface Area (PSA)
125.4
ChemAxon
Refractivity
64.88
ChemAxon
Polarizability
26.49
ChemAxon
Rotatable Bond Count
3
ChemAxon
H Bond Acceptor Count
7
ChemAxon
H Bond Donor Count
5
ChemAxon
pKa (strongest acidic)
12.2
ChemAxon
pKa (strongest basic)
4.74
ChemAxon
Physiological Charge
0
ChemAxon
Number of Rings
2
ChemAxon
Bioavailability
1
ChemAxon
Rule of Five
true
ChemAxon
PubChem Compound
88702
PubChem Substance
46508603
PDB
GAT
BE0001477
Heat-labile enterotoxin B chain
Escherichia coli
# 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
Heat-labile enterotoxin B chain
The biological activity of the toxin is produced by the A chain, which activates intracellular adenyl cyclase
eltB
None
9.12
14134.0
Escherichia coli
GenBank Gene Database
M17873
GenBank Protein Database
145833
UniProtKB
P32890
UniProt Accession
ELBP_ECOLX
Heat-labile enterotoxin B chain precursor
LT-B, porcine
LTP-B
>Heat-labile enterotoxin B chain precursor
MNKVKCYVLFTALLSSLYAHGAPQTITELCSEYRNTQIYTINDKILSYTESMAGKREMVI
ITFKSGETFQVEVPGSQHIDSQKKAIERMKDTLRITYLTETKIDKLCVWNNKTPNSIAAI
SMKN
>375 bp
ATGAATAAAGTAAAATGTTATGTTTTATTTACGGCGTTACTATCCTCTCTATATGCACAC
GGAGCTCCCCAGACTATTACAGAACTATGTTCGGAATATCGCAACACACAAATATATACG
ATAAATGACAAGATACTATCATATACGGAATCGATGGCAGGCAAAAGAGAAATGGTTATC
ATTACATTTAAGAGCGGCGAAACATTTCAGGTCGAAGTCCCGGGCAGTCAACATATAGAC
TCCCAGAAAAAAGCCATTGAAAGGATGAAGGACACATTAAGAATCACATATCTGACCGAG
ACCAAAATTGATAAATTATGTGTATGGAATAATAAAACCCCCAATTCAATTGCGGCAATC
AGTATGAAAAACTAG
PF01376
Enterotoxin_b
component
extracellular region
process
interaction between organisms
process
interspecies interaction between organisms
process
symbiosis, encompassing mutualism through parasitism
process
pathogenesis
"
|
| 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