Placidene E

Details

• Internal ID: c48517f5-adc0-4478-b070-7c52984b0feb
• Taxonomy: Organoheterocyclic compounds > Pyrans > Pyranones and derivatives
• IUPAC Name: 4-methoxy-5-methyl-6-pentan-2-ylpyran-2-one
• InChI: InChI=1S/C12H18O3/c1-5-6-8(2)12-9(3)10(14-4)7-11(13)15-12/h7-8H,5-6H2,1-4H3
• InChI Key: DCIVCXJJSXPMID-UHFFFAOYSA-N
• Popularity: 1 reference in papers

Physical and Chemical Properties

• Molecular Formula: C₁₂H₁₈O₃
• Molecular Weight: 210.27 g/mol
• Exact Mass: 210.125594432 g/mol
• Topological Polar Surface Area (TPSA): 35.50 Ų
• XlogP: 2.40

Synonyms

• CHEMBL477530

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	97.08%	98.95%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	92.64%	95.56%
CHEMBL2635	P51452	Dual specificity protein phosphatase 3	90.98%	94.00%
CHEMBL3060	Q9Y345	Glycine transporter 2	90.72%	99.17%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	89.99%	96.09%
CHEMBL5845	P23415	Glycine receptor subunit alpha-1	88.38%	90.71%
CHEMBL4203	Q9HAZ1	Dual specificity protein kinase CLK4	87.90%	94.45%
CHEMBL4657	Q6V1X1	Dipeptidyl peptidase VIII	85.22%	97.21%
CHEMBL1293249	Q13887	Kruppel-like factor 5	84.81%	86.33%
CHEMBL1907	P15144	Aminopeptidase N	84.44%	93.31%
CHEMBL2535	P11166	Glucose transporter	84.32%	98.75%
CHEMBL3401	O75469	Pregnane X receptor	84.02%	94.73%
CHEMBL1075094	Q16236	Nuclear factor erythroid 2-related factor 2	83.85%	96.00%
CHEMBL4105838	Q96GG9	DCN1-like protein 1	80.46%	95.00%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 11183425
• LOTUS: LTS0079078
• wikiData: Q104975425