Local view for "http://wifo5-04.informatik.uni-mannheim.de/drugbank/resource/drugs/DB03500"

Predicate	Value (sorted: none)
owl:sameAs	drug:EXPT01377
rdfs:label	"Tricosanoic Acid"
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 "
rdf:type	drugbank:drugs

All properties reside in the graph file:///home/swish/src/ClioPatria/guidelines3/drugbank_small.nt

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