Hexadecatetraene

Details

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Internal ID 0d662b46-a244-4599-a2de-399db3f3934a
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Olefins > Acyclic olefins > Alkatetraenes
IUPAC Name hexadeca-1,3,5,7-tetraene
SMILES (Canonical) CCCCCCCCC=CC=CC=CC=C
SMILES (Isomeric) CCCCCCCCC=CC=CC=CC=C
InChI InChI=1S/C16H26/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3,5,7,9,11,13,15H,1,4,6,8,10,12,14,16H2,2H3
InChI Key ZBBDKRNPCGSLRR-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C16H26
Molecular Weight 218.38 g/mol
Exact Mass 218.203450829 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 7.00

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Hexadecatetraene

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
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 94.93% 92.08%
CHEMBL230 P35354 Cyclooxygenase-2 94.09% 89.63%
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 93.23% 92.86%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 92.65% 97.29%
CHEMBL3060 Q9Y345 Glycine transporter 2 91.34% 99.17%
CHEMBL2581 P07339 Cathepsin D 89.88% 98.95%
CHEMBL5043 Q6P179 Endoplasmic reticulum aminopeptidase 2 89.41% 91.81%
CHEMBL240 Q12809 HERG 89.14% 89.76%
CHEMBL2885 P07451 Carbonic anhydrase III 89.03% 87.45%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 88.16% 85.94%
CHEMBL1907 P15144 Aminopeptidase N 83.32% 93.31%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 82.59% 96.95%
CHEMBL221 P23219 Cyclooxygenase-1 81.63% 90.17%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 80.87% 96.09%
CHEMBL2274 Q9H228 Sphingosine 1-phosphate receptor Edg-8 80.87% 100.00%

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 54372774
LOTUS LTS0231782
wikiData Q104375612