Bioactive Compound Details

BioIDbio1584
NameANTHEMINONE C
ChEMBL IDCHEMBL252202
Molecular FormulaC15H24O4
Molecular Weight268.35
Molecular Weight (Monoisotopic)268.1675
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonymsantheminone C
SmilesC=C1C(=O)C[C@@H](C(C)(O)CCC=C(C)C)[C@H](O)[C@H]1O
InchiInChI=1S/C15H24O4/c1-9(2)6-5-7-15(4,19)11-8-12(16)10(3)13(17)14(11)18/h6,11,13-14,17-19H,3,5,7-8H2,1-2,4H3/t11-,13+,14+,15?/m1/s1
Inchi KeyCBBNBHQRNCDHQF-LKWLHFCZSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities6.0
Np Likeness Score2.55
Records Key['3, antheminone C']
Records Name['3,4-dihydroxy-5-(1-hydroxy-1,5-dimethyl-4-hexenyl)-2-methylenecyclohexanone']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure