(6E,9E)-icosa-6,9-diene

Details

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Internal ID 4de6f204-57e5-457f-a60d-f4c36dba68a6
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Olefins > Acyclic olefins > Alkadienes
IUPAC Name (6E,9E)-icosa-6,9-diene
SMILES (Canonical) CCCCCCCCCCC=CCC=CCCCCC
SMILES (Isomeric) CCCCCCCCCC/C=C/C/C=C/CCCCC
InChI InChI=1S/C20H38/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h11,13,17,19H,3-10,12,14-16,18,20H2,1-2H3/b13-11+,19-17+
InChI Key ZXRQQYKZWAJTJO-GRAPOSQESA-N
Popularity 1 reference in papers

Physical and Chemical Properties

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Molecular Formula C20H38
Molecular Weight 278.50 g/mol
Exact Mass 278.297351212 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 9.40

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (6E,9E)-icosa-6,9-diene

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 96.01% 92.08%
CHEMBL230 P35354 Cyclooxygenase-2 95.44% 89.63%
CHEMBL2581 P07339 Cathepsin D 93.03% 98.95%
CHEMBL3060 Q9Y345 Glycine transporter 2 92.49% 99.17%
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 90.68% 92.86%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 89.47% 85.94%
CHEMBL239 Q07869 Peroxisome proliferator-activated receptor alpha 88.34% 90.75%
CHEMBL5043 Q6P179 Endoplasmic reticulum aminopeptidase 2 87.96% 91.81%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 85.03% 96.09%
CHEMBL221 P23219 Cyclooxygenase-1 84.77% 90.17%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 84.42% 97.29%
CHEMBL1781 P11387 DNA topoisomerase I 83.56% 97.00%
CHEMBL2885 P07451 Carbonic anhydrase III 82.33% 87.45%
CHEMBL1907 P15144 Aminopeptidase N 80.34% 93.31%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Baccharoides anthelmintica

Cross-Links

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PubChem 20407198
LOTUS LTS0071145
wikiData Q105385737