1,4-Eicosadiene

Details

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Internal ID 8e814093-a67f-4ada-bef6-c40232611269
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Olefins > Acyclic olefins > Alkadienes
IUPAC Name icosa-1,4-diene
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C20H38/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3,7,9H,1,4-6,8,10-20H2,2H3
InChI Key VMWPBZLUNCMQTJ-UHFFFAOYSA-N
Popularity 5 references 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 9.80

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 1,4-Eicosadiene

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 95.19% 92.08%
CHEMBL3060 Q9Y345 Glycine transporter 2 92.71% 99.17%
CHEMBL2581 P07339 Cathepsin D 92.66% 98.95%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 89.50% 85.94%
CHEMBL5043 Q6P179 Endoplasmic reticulum aminopeptidase 2 88.69% 91.81%
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 88.00% 92.86%
CHEMBL230 P35354 Cyclooxygenase-2 87.29% 89.63%
CHEMBL2885 P07451 Carbonic anhydrase III 86.37% 87.45%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 86.23% 97.29%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 85.04% 96.09%
CHEMBL335 P18031 Protein-tyrosine phosphatase 1B 84.55% 95.17%
CHEMBL221 P23219 Cyclooxygenase-1 83.39% 90.17%
CHEMBL239 Q07869 Peroxisome proliferator-activated receptor alpha 83.28% 90.75%
CHEMBL1781 P11387 DNA topoisomerase I 82.20% 97.00%
CHEMBL1907 P15144 Aminopeptidase N 81.46% 93.31%
CHEMBL3401 O75469 Pregnane X receptor 80.65% 94.73%

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.
Paronychia kapela

Cross-Links

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PubChem 549368
LOTUS LTS0205952
wikiData Q105289349