(6E,9R)-2,6,14-trimethyl-10-methylidene-9-[(3R)-3-methylpent-4-enyl]pentadeca-2,6-diene

Details

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Internal ID ded44abc-f485-4a85-b1f0-d2b2caed254d
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesterterpenoids
IUPAC Name (6E,9R)-2,6,14-trimethyl-10-methylidene-9-[(3R)-3-methylpent-4-enyl]pentadeca-2,6-diene
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C25H44/c1-9-22(6)16-18-25(24(8)15-11-13-21(4)5)19-17-23(7)14-10-12-20(2)3/h9,12,17,21-22,25H,1,8,10-11,13-16,18-19H2,2-7H3/b23-17+/t22-,25+/m0/s1
InChI Key QNCOYEQQDOUCMW-VURWIQAASA-N
Popularity 3 references in papers

Physical and Chemical Properties

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Molecular Formula C25H44
Molecular Weight 344.60 g/mol
Exact Mass 344.344301404 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 10.40

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (6E,9R)-2,6,14-trimethyl-10-methylidene-9-[(3R)-3-methylpent-4-enyl]pentadeca-2,6-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
CHEMBL2581 P07339 Cathepsin D 93.49% 98.95%
CHEMBL2885 P07451 Carbonic anhydrase III 91.22% 87.45%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 90.48% 96.09%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 88.81% 94.45%
CHEMBL3401 O75469 Pregnane X receptor 87.65% 94.73%
CHEMBL2265 P23141 Acyl coenzyme A:cholesterol acyltransferase 87.05% 85.94%
CHEMBL3359 P21462 Formyl peptide receptor 1 85.05% 93.56%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 84.49% 91.11%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 83.10% 97.29%
CHEMBL1907605 P24864 Cyclin-dependent kinase 2/cyclin E1 82.93% 92.88%
CHEMBL2107 P61073 C-X-C chemokine receptor type 4 82.47% 93.10%
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 82.03% 92.08%
CHEMBL4657 Q6V1X1 Dipeptidyl peptidase VIII 81.72% 97.21%
CHEMBL3060 Q9Y345 Glycine transporter 2 81.15% 99.17%
CHEMBL5845 P23415 Glycine receptor subunit alpha-1 80.37% 90.71%
CHEMBL3130 O00329 PI3-kinase p110-delta subunit 80.17% 96.47%
CHEMBL203 P00533 Epidermal growth factor receptor erbB1 80.12% 97.34%

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 101024693
LOTUS LTS0197879
wikiData Q105224334