Bioactive Compound Details

BioIDbio199812
Name2-exo-butoxy-1,4-cineole
ChEMBL IDCHEMBL2229605
Molecular FormulaC14H24O3
Molecular Weight240.34
Molecular Weight (Monoisotopic)240.1725
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsNone
SmilesCCCC(=O)O[C@@H]1C[C@@]2(C(C)C)CC[C@@]1(C)O2
InchiInChI=1S/C14H24O3/c1-5-6-12(15)16-11-9-14(10(2)3)8-7-13(11,4)17-14/h10-11H,5-9H2,1-4H3/t11-,13-,14-/m1/s1
Inchi KeyZKPFHYZAJWKIKY-MRVWCRGKSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities18.0
Np Likeness Score2.24
Records Key['11b, 2-exo-butoxy-1,4-cineole']
Records Name['(+/-)-exo-4-Isopropyl-1-methyl-7-oxabicyclo[2.2.1]heptan-2-yl butanoate']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure