N-Acetylarterenone

Details

• Internal ID: 90556134-1c17-42fd-857c-bc404d3c5983
• Taxonomy: Organic oxygen compounds > Organooxygen compounds > Carbonyl compounds > Phenylketones > Alkyl-phenylketones
• IUPAC Name: N-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]acetamide
• InChI: InChI=1S/C10H11NO4/c1-6(12)11-5-10(15)7-2-3-8(13)9(14)4-7/h2-4,13-14H,5H2,1H3,(H,11,12)
• InChI Key: QOJMCWVKYXUEBC-UHFFFAOYSA-N
• Popularity: 3 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₀H₁₁NO₄
• Molecular Weight: 209.20 g/mol
• Exact Mass: 209.06880783 g/mol
• Topological Polar Surface Area (TPSA): 86.60 Ų
• XlogP: 0.20

Synonyms

• 14522-07-7
• N-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]acetamide
• N-[2-(3,4-DIHYDROXYPHENYL)-2-OXO-ETHYL]ACETAMIDE
• N-(2-(3,4-Dihydroxyphenyl)-2-oxoethyl)acetamide
• SCHEMBL7441728
• DTXSID30162943
• Acetamide, N-(2-(3,4-dihydroxyphenyl)-2-oxoethyl)-

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
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	98.03%	91.11%
CHEMBL4208	P20618	Proteasome component C5	94.10%	90.00%
CHEMBL2581	P07339	Cathepsin D	92.19%	98.95%
CHEMBL3060	Q9Y345	Glycine transporter 2	87.46%	99.17%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	87.26%	96.09%
CHEMBL4657	Q6V1X1	Dipeptidyl peptidase VIII	86.19%	97.21%
CHEMBL3401	O75469	Pregnane X receptor	84.52%	94.73%
CHEMBL1293249	Q13887	Kruppel-like factor 5	82.27%	86.33%
CHEMBL1907591	P30926	Neuronal acetylcholine receptor; alpha4/beta4	81.44%	100.00%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 3082066
• LOTUS: LTS0097353
• wikiData: Q83031760