Bioactive Compound Details

BioIDbio2208
NameNone
ChEMBL IDCHEMBL455338
Molecular FormulaC19H27NO3
Molecular Weight317.43
Molecular Weight (Monoisotopic)317.1991
TypeSmall molecule
Max Phase--
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
Synonyms9-pherylnorajiDyt-L-HSL
SmilesO=C(CCCCCCCCc1ccccc1)N[C@H]1CCOC1=O
InchiInChI=1S/C19H27NO3/c21-18(20-17-14-15-23-19(17)22)13-9-4-2-1-3-6-10-16-11-7-5-8-12-16/h5,7-8,11-12,17H,1-4,6,9-10,13-15H2,(H,20,21)/t17-/m0/s1
Inchi KeyBILVZXNFCKSBHZ-KRWDZBQOSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities3.0
Np Likeness Score-0.16
Records Key['9a, 9-pherylnorajiDyt-L-HSL']
Records Name['N-9-Phenylnonanoyl-L-homoserine Lactone']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure