Geranylbenzoquinone

Details

• Internal ID: fe388956-4617-440f-b4bf-494b6c40de89
• Taxonomy: Lipids and lipid-like molecules > Prenol lipids > Quinone and hydroquinone lipids > Prenylquinones
• IUPAC Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]cyclohexa-2,5-diene-1,4-dione
• InChI: InChI=1S/C16H20O2/c1-12(2)5-4-6-13(3)7-8-14-11-15(17)9-10-16(14)18/h5,7,9-11H,4,6,8H2,1-3H3/b13-7+
• InChI Key: GAJSCEURGWVNBZ-NTUHNPAUSA-N
• Popularity: 5 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₆H₂₀O₂
• Molecular Weight: 244.33 g/mol
• Exact Mass: 244.146329876 g/mol
• Topological Polar Surface Area (TPSA): 34.10 Ų
• XlogP: 3.80

Synonyms

• 61977-06-8
• CHEMBL460650
• C10351
• AC1NQYZS
• Geranyl quinone
• Geranyl-p-benzochinon
• SureCN4740027
• 2-geranyl-1,4-benzoquinone
• SCHEMBL4740027
• GAJSCEURGWVNBZ-NTUHNPAUSA-N
• DTXSID901019883
• NSC324365
• NSC-324365
• DB-220749
• 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,4-benzoquinone
• 2,5-Cyclohexadiene-1,4-dione, 2-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL2581	P07339	Cathepsin D	91.39%	98.95%
CHEMBL4769	O95749	Geranylgeranyl pyrophosphate synthetase	90.77%	92.08%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	88.82%	91.11%
CHEMBL4261	Q16665	Hypoxia-inducible factor 1 alpha	87.37%	85.14%
CHEMBL4203	Q9HAZ1	Dual specificity protein kinase CLK4	85.54%	94.45%
CHEMBL3401	O75469	Pregnane X receptor	84.42%	94.73%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	83.83%	95.56%
CHEMBL221	P23219	Cyclooxygenase-1	80.30%	90.17%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 5281739
• LOTUS: LTS0087398
• wikiData: Q105005444