(6R)-6-ethenylcyclohepta-1,4-diene

Details

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Internal ID 2a2ad185-4b8c-4f1c-b162-c25dc79ac228
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Olefins > Cyclic olefins > Cycloalkenes
IUPAC Name (6R)-6-ethenylcyclohepta-1,4-diene
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C9H12/c1-2-9-7-5-3-4-6-8-9/h2-3,5-6,8-9H,1,4,7H2/t9-/m0/s1
InChI Key WGZPMONOKKDYNV-VIFPVBQESA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C9H12
Molecular Weight 120.19 g/mol
Exact Mass 120.093900383 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 3.10

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (6R)-6-ethenylcyclohepta-1,4-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
CHEMBL253 P34972 Cannabinoid CB2 receptor 88.11% 97.25%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 87.16% 91.11%
CHEMBL1841 P06241 Tyrosine-protein kinase FYN 81.85% 81.29%

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 162902482
LOTUS LTS0081914
wikiData Q105305157