7-Hydroxy-2-(3-hydroxyprop-1-enyl)-6,8-dimethyl-2,3-dihydrochromen-4-one

Details

• Internal ID: 73080af6-3550-45aa-b93a-6aaab7eb4a7a
• Taxonomy: Organoheterocyclic compounds > Benzopyrans > 1-benzopyrans > Chromones
• IUPAC Name: 7-hydroxy-2-(3-hydroxyprop-1-enyl)-6,8-dimethyl-2,3-dihydrochromen-4-one
• InChI: InChI=1S/C14H16O4/c1-8-6-11-12(16)7-10(4-3-5-15)18-14(11)9(2)13(8)17/h3-4,6,10,15,17H,5,7H2,1-2H3
• InChI Key: DWJFKBPKZCZRDV-UHFFFAOYSA-N
• Popularity: 0 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₄H₁₆O₄
• Molecular Weight: 248.27 g/mol
• Exact Mass: 248.10485899 g/mol
• Topological Polar Surface Area (TPSA): 66.80 Ų
• XlogP: 1.40

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
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	95.45%	91.11%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	93.46%	95.56%
CHEMBL1293267	Q9HC97	G-protein coupled receptor 35	92.27%	89.34%
CHEMBL2581	P07339	Cathepsin D	90.81%	98.95%
CHEMBL1806	P11388	DNA topoisomerase II alpha	87.81%	89.00%
CHEMBL1293249	Q13887	Kruppel-like factor 5	84.71%	86.33%
CHEMBL3060	Q9Y345	Glycine transporter 2	82.11%	99.17%
CHEMBL5608	Q16288	NT-3 growth factor receptor	81.39%	95.89%
CHEMBL1994	P08235	Mineralocorticoid receptor	80.64%	100.00%
CHEMBL3401	O75469	Pregnane X receptor	80.40%	94.73%
CHEMBL4530	P00488	Coagulation factor XIII	80.39%	96.00%
CHEMBL1951	P21397	Monoamine oxidase A	80.12%	91.49%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 162814340
• LOTUS: LTS0066313
• wikiData: Q103818753