1-Methylidene-2-prop-1-en-2-ylcyclohexane

Details

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Internal ID 312a04b1-d633-497c-a392-b1102ee488b2
Taxonomy Lipids and lipid-like molecules > Prenol lipids > Monoterpenoids > Monocyclic monoterpenoids
IUPAC Name 1-methylidene-2-prop-1-en-2-ylcyclohexane
SMILES (Canonical) CC(=C)C1CCCCC1=C
SMILES (Isomeric) CC(=C)C1CCCCC1=C
InChI InChI=1S/C10H16/c1-8(2)10-7-5-4-6-9(10)3/h10H,1,3-7H2,2H3
InChI Key KZHNYLAFFGASBN-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C10H16
Molecular Weight 136.23 g/mol
Exact Mass 136.125200510 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 3.80

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 1-Methylidene-2-prop-1-en-2-ylcyclohexane

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
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 92.27% 91.11%
CHEMBL1951 P21397 Monoamine oxidase A 91.95% 91.49%
CHEMBL253 P34972 Cannabinoid CB2 receptor 89.68% 97.25%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 87.13% 96.09%
CHEMBL2581 P07339 Cathepsin D 85.21% 98.95%
CHEMBL5608 Q16288 NT-3 growth factor receptor 83.40% 95.89%
CHEMBL241 Q14432 Phosphodiesterase 3A 83.01% 92.94%
CHEMBL3137262 O60341 LSD1/CoREST complex 81.42% 97.09%

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.
Citrus × aurantium

Cross-Links

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PubChem 91087044
LOTUS LTS0192345
wikiData Q105148151