1,2-dimethoxy-4-[(1R)-1-methoxyprop-2-enyl]benzene

Details

• Internal ID: 1adc6e2c-bd79-4082-bf98-2cc81aeeb42a
• Taxonomy: Benzenoids > Benzene and substituted derivatives > Methoxybenzenes > Dimethoxybenzenes
• IUPAC Name: 1,2-dimethoxy-4-[(1R)-1-methoxyprop-2-enyl]benzene
• InChI: InChI=1S/C12H16O3/c1-5-10(13-2)9-6-7-11(14-3)12(8-9)15-4/h5-8,10H,1H2,2-4H3/t10-/m1/s1
• InChI Key: DARGUPSDBIBHDD-SNVBAGLBSA-N
• Popularity: 2 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₂H₁₆O₃
• Molecular Weight: 208.25 g/mol
• Exact Mass: 208.109944368 g/mol
• Topological Polar Surface Area (TPSA): 27.70 Ų
• XlogP: 2.00

Synonyms

There are no found synonyms.

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
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	91.75%	96.09%
CHEMBL1255126	O15151	Protein Mdm4	90.95%	90.20%
CHEMBL225	P28335	Serotonin 2c (5-HT2c) receptor	90.63%	89.62%
CHEMBL1075094	Q16236	Nuclear factor erythroid 2-related factor 2	88.17%	96.00%
CHEMBL1293249	Q13887	Kruppel-like factor 5	88.04%	86.33%
CHEMBL4208	P20618	Proteasome component C5	87.78%	90.00%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	85.07%	95.56%
CHEMBL3492	P49721	Proteasome Macropain subunit	83.55%	90.24%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	83.20%	91.11%
CHEMBL2581	P07339	Cathepsin D	83.01%	98.95%

Plants that contains it

• Morina chinensis

Cross-Links

• PubChem: 162908621
• LOTUS: LTS0234570
• wikiData: Q104973884