(2R,3E,5E)-2-methyltetradeca-3,5-dienoic acid

Details

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Internal ID 0403b3f8-ee4d-4f25-8554-fa1ec4e089f8
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty acids and conjugates > Long-chain fatty acids
IUPAC Name (2R,3E,5E)-2-methyltetradeca-3,5-dienoic acid
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15(16)17/h10-14H,3-9H2,1-2H3,(H,16,17)/b11-10+,13-12+/t14-/m1/s1
InChI Key HNUJIMGRYLHDBS-PBKZMAJUSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C15H26O2
Molecular Weight 238.37 g/mol
Exact Mass 238.193280068 g/mol
Topological Polar Surface Area (TPSA) 37.30 Ų
XlogP 5.70

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (2R,3E,5E)-2-methyltetradeca-3,5-dienoic acid

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3060 Q9Y345 Glycine transporter 2 96.32% 99.17%
CHEMBL2581 P07339 Cathepsin D 95.90% 98.95%
CHEMBL3359 P21462 Formyl peptide receptor 1 93.37% 93.56%
CHEMBL221 P23219 Cyclooxygenase-1 92.55% 90.17%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 92.49% 97.29%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 90.74% 96.09%
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 89.60% 92.86%
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 89.23% 92.08%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 88.08% 85.94%
CHEMBL3130 O00329 PI3-kinase p110-delta subunit 87.83% 96.47%
CHEMBL230 P35354 Cyclooxygenase-2 86.13% 89.63%
CHEMBL1907591 P30926 Neuronal acetylcholine receptor; alpha4/beta4 85.23% 100.00%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 84.37% 96.95%
CHEMBL2274 Q9H228 Sphingosine 1-phosphate receptor Edg-8 83.72% 100.00%
CHEMBL2885 P07451 Carbonic anhydrase III 83.67% 87.45%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 83.04% 96.00%
CHEMBL4227 P25090 Lipoxin A4 receptor 81.29% 100.00%
CHEMBL1781 P11387 DNA topoisomerase I 80.68% 97.00%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 80.67% 89.34%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 80.01% 94.45%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 163104308
LOTUS LTS0052610
wikiData Q105031071