Euryopsonol

Details

• Internal ID: a76062cd-82a4-42f7-9dca-744933d95fd8
• Taxonomy: Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids > Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
• IUPAC Name: (4aR,5S,6S,8aS)-3,4a,5-trimethyl-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-6-ol
• InChI: InChI=1S/C15H22O2/c1-9-8-17-14-6-11-4-5-13(16)10(2)15(11,3)7-12(9)14/h8,10-11,13,16H,4-7H2,1-3H3/t10-,11+,13+,15+/m1/s1
• InChI Key: UIWPDJPOLFTUJI-MPXAEWJHSA-N
• Popularity: 0 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₅H₂₂O₂
• Molecular Weight: 234.33 g/mol
• Exact Mass: 234.161979940 g/mol
• Topological Polar Surface Area (TPSA): 33.40 Ų
• XlogP: 3.30

Synonyms

• NSC113234
• (4aR,5S,6S,8aS)-3,4a,5-Trimethyl-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-b]furan-6-ol
• (4aR,5S,6S,8aS)-3,4a,5-trimethyl-5,6,7,8,8a,9-hexahydro-4H-benzo[f]benzofuran-6-ol

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	96.04%	91.11%
CHEMBL3137262	O60341	LSD1/CoREST complex	89.85%	97.09%
CHEMBL4803	P29474	Nitric-oxide synthase, endothelial	83.91%	86.00%
CHEMBL1994	P08235	Mineralocorticoid receptor	83.57%	100.00%
CHEMBL241	Q14432	Phosphodiesterase 3A	83.46%	92.94%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	83.41%	95.56%
CHEMBL1806	P11388	DNA topoisomerase II alpha	81.44%	89.00%
CHEMBL3359	P21462	Formyl peptide receptor 1	81.34%	93.56%
CHEMBL2553	Q15418	Ribosomal protein S6 kinase alpha 1	81.27%	85.11%
CHEMBL5608	Q16288	NT-3 growth factor receptor	81.04%	95.89%
CHEMBL2581	P07339	Cathepsin D	80.65%	98.95%

Plants that contains it

• Euryops floribundus

Cross-Links

• PubChem: 3003831
• LOTUS: LTS0122122
• wikiData: Q105273643