Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB03500"
Predicate | Value (sorted: default) |
---|---|
rdfs:label |
"Tricosanoic Acid"
|
rdf:type | |
drugbank:description |
"
experimental
This compound belongs to the straight chain fatty acids. These are fatty acids with a straight aliphatic chain.
Straight Chain Fatty Acids
Organic Compounds
Lipids
Fatty Acids and Conjugates
Straight Chain Fatty Acids
Polyamines
Enolates
Carboxylic Acids
enolate
polyamine
carboxylic acid
carboxylic acid derivative
logP
9.39
ALOGPS
logS
-7.1
ALOGPS
Water Solubility
2.57e-05 g/l
ALOGPS
logP
9.37
ChemAxon
IUPAC Name
tricosanoic acid
ChemAxon
Traditional IUPAC Name
tricosanoic acid
ChemAxon
Molecular Weight
354.6101
ChemAxon
Monoisotopic Weight
354.349780716
ChemAxon
SMILES
CCCCCCCCCCCCCCCCCCCCCCC(O)=O
ChemAxon
Molecular Formula
C23H46O2
ChemAxon
InChI
InChI=1S/C23H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25/h2-22H2,1H3,(H,24,25)
ChemAxon
InChIKey
InChIKey=XEZVDURJDFGERA-UHFFFAOYSA-N
ChemAxon
Polar Surface Area (PSA)
37.3
ChemAxon
Refractivity
109.29
ChemAxon
Polarizability
49.4
ChemAxon
Rotatable Bond Count
21
ChemAxon
H Bond Acceptor Count
2
ChemAxon
H Bond Donor Count
1
ChemAxon
pKa (strongest acidic)
4.95
ChemAxon
Physiological Charge
-1
ChemAxon
Number of Rings
0
ChemAxon
Bioavailability
0
ChemAxon
ChEBI
42394
PubChem Compound
17085
PubChem Substance
46507803
PDB
F23
BE0001503
Lipase 3
Yeast
# 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
Lipase 3
Lipid transport and metabolism
Triacylglycerol + H(2)O = diacylglycerol + a carboxylate
LIP3
None
5.24
58755.0
Yeast
GenBank Gene Database
X66006
GenBank Protein Database
1325989
UniProtKB
P32947
UniProt Accession
LIP3_CANRU
Cholesterol esterase
EC 3.1.1.3
Lipase 3 precursor
>Lipase 3 precursor
MKLALALSLIASVAAAPTAKLANGDTITGLNAIINEAFLGIPFAEPPVGNLRFKDPVPYS
GSLNGQKFTSYGPSCMQQNPEGTFEENLGKTALDLVMQSKVFQAVLPQSEDCLTINVVRP
PGTKAGANLPVMLWIFGGGFEIGSPTIFPPAQMVTKSVLMGKPIIHVAVNYRVASWGFLA
GDDIKAEGSGNAGLKDQRLGMQWVADNIAGFGGDPSKVTIFGESAGSMSVLCHLIWNDGD
NTYKGKPLFRAGIMQSGAMVPSDPVDGTYGNEIYDLFVSSAGCGSASDKLACLRSASSDT
LLDATNNTPGFLAYSSLRLSYLPRPDGKNITDDMYKLVRDGKYASVPVIIGDQNDEGTIF
GLSSLNVTTNAQARAYFKQSFIHASDAEIDTLMAAYPQDITQGSPFDTGIFNAITPQFKR
ISAVLGDLAFIHARRYFLNHFQGGTKYSFLSKQLSGLPIMGTFHANDIVWQDYLLGSGSV
IYNNAFIAFATDLDPNTAGLLVNWPKYTSSSQSGNNLMMINALGLYTGKDNFRTAGYDAL
MTNPSSFFV
>1650 bp
ATGAAGCTCGCTCTTGCGCTCCTGCTCATTGCCTCGGTGGCTGCCGCCCCCACCGCCAAG
CTCGCCAACGGCGACACCATCACCGGTCTCAACGCCATCATCAACGAGGCGTTCCTCGGC
ATTCCCTTTGCCGAGCCGCCGGTGGGCAACCTCCGCTTCAAGGACCCTGTGCCGTACTCT
GGCTCGCTCAACGGCCAGAAGTTTACTCTGTACGGCCCGCTGTGCATGCAGCAGAACCCC
GAGGGCACGTTTGAAGAGAACCTTGGCAAGACGGCACTCGACTTGGTGATGCAGTCCAAG
GTGTTCCAGGCGGTGCTTCCCCAGAGTGAGGACTGCCTCACCATCAACGTGGTGCGGCCG
CCGGGCACCAAGGCGGGCGCCAACCTCCCGGTCATGCTCTGGATCTTTGGCGGTGGGTTT
GAGATCGGCAGCCCCACCATCTTCCCTCCCGCCCAGATGGTCACCAAGAGTGTGCTCATG
GGCAAGCCCATCATCCACGTGGCCGTCAACTACCGTGTTGCCTCGTGGGGGTTCTTGGCT
GGTGATGACATCAAGGCCGAGGGCAGCGGGAACGCCGGCTTGAAGGACCAGCGTTTGGGC
ATGCAGTGGGTGGCAGACAACATTGCCGGGTTCGGCGGCGACCCGAGCAAGGTGACGATC
TTTGGCGAGCTGGCGGGCAGCATGTCCGTGTTGTGCCACCTCATCTGGAACGACGGCGAC
AACACGTACAAGGGCAAGCCGTTGTTCCGCGCGGGCATCATGCAGCTGGGAGCCATGGTG
CCGCTGGACCCGGTGGACGGCACGTACGGCAACGAGATCTACGACCTCTTTGTCTCGAGT
GCTGGCTGTGGCAGCGCCAGCGACAAGCTCGCGTGCTTGCGCAGTGCGCTGAGCGACACC
TTGCTCGATGCCACCAACAACACTCCTGGGTTCTTGGCGTACTCCTCGTTGCGGTTGCTG
TACCTTCCCCGGCCCGACGGCAAGAACATCACCGATGACATGTACAAGTTGGTGCGCGAC
GGCAAGTATGCAAGCGTTCCCGTGATCATTGGCGACCAGAACGACGAGGGCACCATCTTT
GGTCTCCTGCTGTTGAACGTGACCACGAATGCTCAGGCCCGTGCTTACTTCAAGCAGCTG
TTCATCCACGCCAGCGACGCGGAGATCGACACCTTGATGGCGGCGTACCCCCAGGACATC
ACCCAGGGTCTGCCGTTCGACACCGGCATCTTCAACGCAATCACCCCGCAGTTCAAGAGA
ATCCTGGCGGTGCTCGGCGACCTTGCATTCATCCACGCCCGCCGCTACTTCCTCAACCAC
TTCCAGGGCGGCACCAAGTACTCGTTCCTCCTGAAGCAGCTCCTGGGGTTGCCAATCATG
GGCACCTTCCATGCCAACGACATTGTGTGGCAGGACTACTTGTTGGGAAGCGGCAGCGTC
ATCTACAACAACGCGTTTATCGCGTTCGCCACCGACTTGGACCCCAACACCGCGGGGTTG
TTGGTGAACTGGCCCAAGTACACCAGCAGCCTGCAGCTGGGCAACAACTTGATGATGATC
AACGCCTTGGGCTTGTACACCGGCAAGGACAACTTCCGCACCGCTGGCTACGACGCGTTG
ATGACCAACCCGCTGCTGTTCTTTGTGTAG
PF00135
COesterase
"
|
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