2,6,10-Trimethyldodeca-2,6,10-triene

Details

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Internal ID 32eb221c-2fa5-4184-96f7-6a47b515f7bf
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids
IUPAC Name 2,6,10-trimethyldodeca-2,6,10-triene
SMILES (Canonical) CC=C(C)CCC=C(C)CCC=C(C)C
SMILES (Isomeric) CC=C(C)CCC=C(C)CCC=C(C)C
InChI InChI=1S/C15H26/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9,12H,7-8,10-11H2,1-5H3
InChI Key JXBSHSBNOVLGHF-UHFFFAOYSA-N
Popularity 6 references in papers

Physical and Chemical Properties

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Molecular Formula C15H26
Molecular Weight 206.37 g/mol
Exact Mass 206.203450829 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 6.00

Synonyms

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7681-88-1
2,6,10-trimethyl-2,6,10-dodecatriene
DTXSID00998135
AKOS030255143
3,7,11-trimethyl-2,6,10-dodecatriene
Q27116874

2D Structure

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2D Structure of 2,6,10-Trimethyldodeca-2,6,10-triene

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 97.29% 92.08%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 86.24% 96.09%
CHEMBL3401 O75469 Pregnane X receptor 82.58% 94.73%
CHEMBL2581 P07339 Cathepsin D 82.13% 98.95%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 80.66% 91.11%
CHEMBL2107 P61073 C-X-C chemokine receptor type 4 80.27% 93.10%

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.
Santalum spicatum

Cross-Links

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PubChem 4475483
LOTUS LTS0096537
wikiData Q27116874