Bioactive Compound Details

BioIDbio878
NameNIGERAPYRONE C
ChEMBL IDCHEMBL1823131
Molecular FormulaC13H14O4
Molecular Weight234.25
Molecular Weight (Monoisotopic)234.0892
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsNigerapyrone C
SmilesCOc1cc(/C=C/C(C)=C/C(C)=O)oc(=O)c1
InchiInChI=1S/C13H14O4/c1-9(6-10(2)14)4-5-11-7-12(16-3)8-13(15)17-11/h4-8H,1-3H3/b5-4+,9-6+
Inchi KeyLGJCELWOOPXKFE-HSKKLARCSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities6.0
Np Likeness Score1.24
Records Key['3']
Records Name['Nigerapyrone C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure