Flammuspirone D

Details

• Internal ID: f463bc19-af8c-42f4-930d-fcf593e1cf64
• Taxonomy: Lipids and lipid-like molecules > Prenol lipids > Monoterpenoids > Menthane monoterpenoids
• IUPAC Name: (5R,6R,9R,10R)-10-hydroxy-6-(hydroxymethyl)-9-(2-hydroxypropan-2-yl)-3-methylspiro[4.5]dec-3-en-2-one
• InChI: InChI=1S/C15H24O4/c1-9-6-15(7-12(9)17)10(8-16)4-5-11(13(15)18)14(2,3)19/h6,10-11,13,16,18-19H,4-5,7-8H2,1-3H3/t10-,11+,13+,15-/m0/s1
• InChI Key: YYZWBXPTQXUTFC-MDHDOXDCSA-N
• Popularity: 2 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₅H₂₄O₄
• Molecular Weight: 268.35 g/mol
• Exact Mass: 268.16745924 g/mol
• Topological Polar Surface Area (TPSA): 77.80 Ų
• XlogP: 0.90

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
CHEMBL253	P34972	Cannabinoid CB2 receptor	97.19%	97.25%
CHEMBL2581	P07339	Cathepsin D	95.60%	98.95%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	93.02%	91.11%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	90.66%	96.09%
CHEMBL3137262	O60341	LSD1/CoREST complex	90.14%	97.09%
CHEMBL5966	P55899	IgG receptor FcRn large subunit p51	89.91%	90.93%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	87.65%	95.56%
CHEMBL3351	Q13085	Acetyl-CoA carboxylase 1	87.22%	93.04%
CHEMBL1806	P11388	DNA topoisomerase II alpha	82.21%	89.00%
CHEMBL5608	Q16288	NT-3 growth factor receptor	81.87%	95.89%
CHEMBL1937	Q92769	Histone deacetylase 2	81.65%	94.75%
CHEMBL218	P21554	Cannabinoid CB1 receptor	80.79%	96.61%
CHEMBL3713062	P10646	Tissue factor pathway inhibitor	80.73%	97.33%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 132583211
• LOTUS: LTS0126163
• wikiData: Q105369056