5-(1,5-Dimethyl-4-hexenyl)-2-methylene-3-cyclo-hexanol

Details

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Internal ID 884eddbf-30bb-44d8-9144-5e531b3045bd
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids
IUPAC Name 5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohexan-1-ol
SMILES (Canonical) CC(CCC=C(C)C)C1CCC(=C)C(C1)O
SMILES (Isomeric) CC(CCC=C(C)C)C1CCC(=C)C(C1)O
InChI InChI=1S/C15H26O/c1-11(2)6-5-7-12(3)14-9-8-13(4)15(16)10-14/h6,12,14-16H,4-5,7-10H2,1-3H3
InChI Key SKAUBXZIXVGASZ-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C15H26O
Molecular Weight 222.37 g/mol
Exact Mass 222.198365449 g/mol
Topological Polar Surface Area (TPSA) 20.20 Ų
XlogP 4.30

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 5-(1,5-Dimethyl-4-hexenyl)-2-methylene-3-cyclo-hexanol

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
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 92.55% 94.45%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 88.59% 91.11%
CHEMBL226 P30542 Adenosine A1 receptor 88.20% 95.93%
CHEMBL253 P34972 Cannabinoid CB2 receptor 88.05% 97.25%
CHEMBL2581 P07339 Cathepsin D 87.85% 98.95%
CHEMBL6136 O60341 Lysine-specific histone demethylase 1 85.66% 95.58%
CHEMBL5608 Q16288 NT-3 growth factor receptor 84.65% 95.89%
CHEMBL3137262 O60341 LSD1/CoREST complex 84.41% 97.09%
CHEMBL221 P23219 Cyclooxygenase-1 84.24% 90.17%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 84.18% 96.09%
CHEMBL3359 P21462 Formyl peptide receptor 1 83.95% 93.56%
CHEMBL1994 P08235 Mineralocorticoid receptor 82.94% 100.00%
CHEMBL1951 P21397 Monoamine oxidase A 80.59% 91.49%
CHEMBL1907598 P05106 Integrin alpha-V/beta-3 80.32% 95.71%
CHEMBL1907594 P30926 Neuronal acetylcholine receptor; alpha3/beta4 80.13% 97.23%

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.
Zingiber officinale

Cross-Links

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PubChem 139291555
LOTUS LTS0074008
wikiData Q105254701