(2E,4E,7S)-3,7,11-trimethyldodeca-2,4-diene

Details

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Internal ID 82fe1791-08ec-42b8-9386-ea23739b11ba
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids
IUPAC Name (2E,4E,7S)-3,7,11-trimethyldodeca-2,4-diene
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C15H28/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,8,10,13,15H,7,9,11-12H2,1-5H3/b10-8+,14-6+/t15-/m0/s1
InChI Key QUFVBBANWSSNQF-RGUZAKIQSA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C15H28
Molecular Weight 208.38 g/mol
Exact Mass 208.219100893 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 6.60

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (2E,4E,7S)-3,7,11-trimethyldodeca-2,4-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
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 88.28% 97.29%
CHEMBL2885 P07451 Carbonic anhydrase III 87.34% 87.45%
CHEMBL2581 P07339 Cathepsin D 86.76% 98.95%
CHEMBL3401 O75469 Pregnane X receptor 84.98% 94.73%
CHEMBL3060 Q9Y345 Glycine transporter 2 82.35% 99.17%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 82.26% 94.45%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 82.07% 96.09%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 81.03% 91.11%
CHEMBL3359 P21462 Formyl peptide receptor 1 80.74% 93.56%

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.
There are no matching plants.

Cross-Links

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PubChem 11063664
LOTUS LTS0089428
wikiData Q105228140