(-)-3a-Hydroxyfuroindoline

Details

• Internal ID: 1f9c7f45-1f6f-446c-9b1e-fd3dc10ef8b2
• Taxonomy: Organoheterocyclic compounds > Indoles and derivatives > Indolines
• IUPAC Name: (3aS,8bR)-1,2,3a,4-tetrahydrofuro[2,3-b]indol-8b-ol
• InChI: InChI=1S/C10H11NO2/c12-10-5-6-13-9(10)11-8-4-2-1-3-7(8)10/h1-4,9,11-12H,5-6H2/t9-,10+/m0/s1
• InChI Key: ARMDWESWZUMWSO-VHSXEESVSA-N
• Popularity: 4 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₀H₁₁NO₂
• Molecular Weight: 177.20 g/mol
• Exact Mass: 177.078978594 g/mol
• Topological Polar Surface Area (TPSA): 41.50 Ų
• XlogP: 0.80

Synonyms

• CHEMBL208023
• SCHEMBL14682350

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	97.76%	91.11%
CHEMBL2716	Q8WUI4	Histone deacetylase 7	88.52%	89.44%
CHEMBL3137262	O60341	LSD1/CoREST complex	87.57%	97.09%
CHEMBL2035	P08912	Muscarinic acetylcholine receptor M5	85.97%	94.62%
CHEMBL4026	P40763	Signal transducer and activator of transcription 3	85.69%	82.69%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	85.67%	96.09%
CHEMBL3310	Q96DB2	Histone deacetylase 11	84.64%	88.56%
CHEMBL1937	Q92769	Histone deacetylase 2	83.57%	94.75%
CHEMBL2553	Q15418	Ribosomal protein S6 kinase alpha 1	83.32%	85.11%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 11355813
• LOTUS: LTS0025319
• wikiData: Q77573312