Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB04327"
| Predicate | Value (sorted: none) |
|---|---|
| rdfs:label |
"Phosphatidylethanolamine"
|
| rdf:type | |
| owl:sameAs | |
| drugbank:description |
"
experimental
This compound belongs to the phosphatidylethanolamines. These are glycerophosphoetahnolamines in which two fatty acids are bonded to the glycerol moiety through ester linkages.
Phosphatidylethanolamines
Organic Compounds
Lipids
Glycerophospholipids
Glycerophosphoethanolamines
Fatty Acid Esters
Organophosphate Esters
Organic Phosphoric Acids
Dicarboxylic Acids and Derivatives
Carboxylic Acid Esters
Enolates
Ethers
Polyamines
fatty acid ester
dicarboxylic acid derivative
phosphoric acid ester
organic phosphate
carboxylic acid ester
carboxylic acid derivative
polyamine
ether
enolate
amine
organonitrogen compound
logP
6.93
ALOGPS
logS
-7.3
ALOGPS
Water Solubility
4.03e-05 g/l
ALOGPS
logP
12.23
ChemAxon
IUPAC Name
(2-azaniumylethoxy)[(2S)-2,3-bis(octadecanoyloxy)propoxy]phosphinic acid
ChemAxon
Traditional IUPAC Name
2-aminioethoxy(2S)-2,3-bis(octadecanoyloxy)propoxyphosphinic acid
ChemAxon
Molecular Weight
749.0734
ChemAxon
Monoisotopic Weight
748.585630149
ChemAxon
SMILES
CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](CO[P@](O)(=O)OCC[NH3+])OC(=O)CCCCCCCCCCCCCCCCC
ChemAxon
Molecular Formula
C41H83NO8P
ChemAxon
InChI
InChI=1S/C41H82NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42)50-41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h39H,3-38,42H2,1-2H3,(H,45,46)/p+1/t39-/m0/s1
ChemAxon
InChIKey
InChIKey=LVNGJLRDBYCPGB-KDXMTYKHSA-O
ChemAxon
Polar Surface Area (PSA)
136
ChemAxon
Refractivity
220.7
ChemAxon
Polarizability
95.03
ChemAxon
Rotatable Bond Count
43
ChemAxon
H Bond Acceptor Count
4
ChemAxon
H Bond Donor Count
2
ChemAxon
pKa (strongest acidic)
1.87
ChemAxon
pKa (strongest basic)
10
ChemAxon
Physiological Charge
0
ChemAxon
Number of Rings
0
ChemAxon
Bioavailability
0
ChemAxon
ChEBI
16038
PubChem Compound
17754130
PubChem Substance
46506543
KEGG Compound
C00350
PDB
PEE
BE0003285
Bacteriorhodopsin
Nostoc sp. (strain PCC 7120 / UTEX 2576)
unknown
Bacteriorhodopsin
Involved in ion channel activity
alr3165
None
9.03
30192.0
Nostoc sp. (strain PCC 7120 / UTEX 2576)
GenBank Gene Database
BA000019
UniProtKB
Q8YSC4
UniProt Accession
Q8YSC4_NOSS1
>Bacteriorhodopsin
MNLESLLHWIYVAGMTIGALHFWSLSRNPRGVPQYEYLVAMFIPIWSGLAYMAMAIDQGK
VEAAGQIAHYARYIDWMVTTPLLLLSLSWTAMQFIKKDWTLIGFLMSTQIVVITSGLIAD
LSERDWVRYLWYICGVCAFLIILWGIWNPLRAKTRTQSSELANLYDKLVTYFTVLWIGYP
IVWIIGPSGFGWINQTIDTFLFCLLPFFSKVGFSFLDLHGLRNLNDSRQTTGDRFAENTL
QFVENITLFANSRRQQSRRRV
>786 bp
ATGAATTTGGAGAGTCTTTTACACTGGATTTATGTTGCGGGAATGACAATTGGTGCATTG
CACTTTTGGTCACTTAGTCGAAATCCGCGCGGTGTTCCCCAGTACGAATACCTTGTGGCG
ATGTTTATTCCCATTTGGTCGGGACTAGCCTATATGGCAATGGCAATAGACCAAGGTAAA
GTTGAAGCGGCTGGGCAAATTGCCCACTATGCCCGTTATATTGATTGGATGGTGACAACA
CCATTATTACTGCTATCTCTTTCTTGGACAGCGATGCAGTTTATCAAAAAAGATTGGACA
CTCATTGGTTTTTTGATGAGTACCCAGATAGTTGTAATTACCTCTGGGTTAATCGCAGAT
TTATCTGAGCGCGATTGGGTGAGATATCTATGGTATATCTGCGGGGTTTGCGCTTTTCTC
ATTATTCTTTGGGGTATTTGGAATCCATTGCGCGCCAAAACCAGAACTCAAAGTTCAGAA
CTAGCGAACTTATACGATAAGCTTGTTACTTATTTTACAGTGCTTTGGATAGGCTACCCA
ATAGTCTGGATTATTGGCCCTAGTGGTTTTGGCTGGATAAATCAAACTATAGATACATTT
TTGTTTTGTCTACTGCCCTTTTTCTCCAAGGTTGGATTTAGTTTTCTGGATTTACACGGC
TTACGTAATCTCAATGATTCCCGCCAAACTACTGGCGATCGCTTTGCGGAAAATACTTTA
CAGTTTGTAGAAAATATTACATTATTTGCTAACTCACGACGGCAACAATCACGCAGAAGA
GTTTGA
PF01036
Bac_rhodopsin
component
cell
component
membrane
function
transporter activity
function
ion transporter activity
function
ion channel activity
process
transport
process
ion transport
process
physiological process
process
cellular physiological process
BE0001161
Endothelial protein C receptor
Human
# 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
Endothelial protein C receptor
Involved in protein C biniding activity and blood coagulation
Binds activated protein C. Enhances protein C activation by the thrombin-thrombomodulin complex; plays a role in the protein C pathway controlling blood coagulation
PROCR
20q11.2
Membrane; single-pass type I membrane protein
211-231
7.2
26672.0
Human
HUGO Gene Nomenclature Committee (HGNC)
HGNC:9452
GenAtlas
PROCR
GeneCards
PROCR
GenBank Gene Database
L35545
GenBank Protein Database
565268
UniProtKB
Q9UNN8
UniProt Accession
EPCR_HUMAN
Activated protein C receptor
APC receptor
CD201 antigen
Endothelial cell protein C receptor
Endothelial protein C receptor precursor
>Endothelial protein C receptor precursor
MLTTLLPILLLSGWAFCSQDASDGLQRLHMLQISYFRDPYHVWYQGNASLGGHLTHVLEG
PDTNTTIIQLQPLQEPESWARTQSGLQSYLLQFHGLVRLVHQERTLAFPLTIRCFLGCEL
PPEGSRAHVFFEVAVNGSSFVSFRPERALWQADTQVTSGVVTFTLQQLNAYNRTRYELRE
FLEDTCVQYVQKHISAENTKGSQTSRSYTSLVLGVLVGSFIIAGVAVGIFLCTGGRRC
>717 bp
ATGTTGACAACATTGCTGCCGATACTGCTGCTGTCTGGCTGGGCCTTTTGTAGCCAAGAC
GCCTCAGATGGCCTCCAAAGACTTCATATGCTCCAGATCTCCTACTTCCGCGACCCCTAT
CACGTGTGGTACCAGGGCAACGCGTCGCTGGGGGGACACCTAACGCACGTGCTGGAAGGC
CCAGACACCAACACCACGATCATTCAGCTGCAGCCCTTGCAGGAGCCCGAGAGCTGGGCG
CGCACGCAGAGTGGCCTGCAGTCCTACCTGCTCCAGTTCCACGGCCTCGTGCGCCTGGTG
CACCAGGAGCGGACCTTGGCCTTTCCTCTGACCATCCGCTGCTTCCTGGGCTGTGAGCTG
CCTCCCGAGGGCTCTAGAGCCCATGTCTTCTTCGAAGTGGCTGTGAATGGGAGCTCCTTT
GTGAGTTTCCGGCCGGAGAGAGCCTTGTGGCAGGCAGACACCCAGGTCACCTCCGGAGTG
GTCACCTTCACCCTGCAGCAGCTCAATGCCTACAACCGCACTCGGTATGAACTGCGGGAA
TTCCTGGAGGACACCTGTGTGCAGTATGTGCAGAAACATATTTCCGCGGAAAACACGAAA
GGGAGCCAAACAAGCCGCTCCTACACTTCGCTGGTCCTGGGCGTCCTGGTGGGCGGTTTC
ATCATTGCTGGTGTGGCTGTAGGCATCTTCCTGTGCACAGGTGGACGGCGATGTTAA
"
|
All properties reside in the graph file:///home/swish/src/ClioPatria/guidelines3/drugbank_small.nt
The resource does not appear as an object