4-(3,3-Dimethylcyclohexylidene)-1-methylcyclohexene

Details

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Internal ID 5dcd13fb-ecbd-4a3a-b169-0362629bfa7a
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Branched unsaturated hydrocarbons
IUPAC Name 4-(3,3-dimethylcyclohexylidene)-1-methylcyclohexene
SMILES (Canonical) CC1=CCC(=C2CCCC(C2)(C)C)CC1
SMILES (Isomeric) CC1=CCC(=C2CCCC(C2)(C)C)CC1
InChI InChI=1S/C15H24/c1-12-6-8-13(9-7-12)14-5-4-10-15(2,3)11-14/h6H,4-5,7-11H2,1-3H3
InChI Key UQOMTASXNKENTG-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C15H24
Molecular Weight 204.35 g/mol
Exact Mass 204.187800766 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 4.00

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 4-(3,3-Dimethylcyclohexylidene)-1-methylcyclohexene

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 91.51% 91.11%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 86.38% 96.09%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 86.36% 95.56%
CHEMBL4803 P29474 Nitric-oxide synthase, endothelial 84.96% 86.00%
CHEMBL2581 P07339 Cathepsin D 83.24% 98.95%
CHEMBL1994 P08235 Mineralocorticoid receptor 80.51% 100.00%

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.
Cupressus macrocarpa

Cross-Links

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PubChem 73804519
LOTUS LTS0073246
wikiData Q105277370