Bioactive Compound Details

BioIDbio482
NameARDISINONE C
ChEMBL IDCHEMBL456514
Molecular FormulaC24H32O6
Molecular Weight416.51
Molecular Weight (Monoisotopic)416.2199
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonymsardisinone C
SmilesCOc1cc(O)c(C(=O)CCCCCCCCCCc2c(O)cccc2O)c(O)c1
InchiInChI=1S/C24H32O6/c1-30-17-15-22(28)24(23(29)16-17)21(27)12-9-7-5-3-2-4-6-8-11-18-19(25)13-10-14-20(18)26/h10,13-16,25-26,28-29H,2-9,11-12H2,1H3
Inchi KeyJLRAGNLAEWIHBK-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets6.0
Bioactivities6.0
Np Likeness Score0.56
Records Key['3, ardisinone C']
Records Name['1-(2,6-dihydroxy-4-methoxyphenyl)-11-(2,6-dihydroxyphenyl)undecan-1-one']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure