Bioactive Compound Details

BioIDbio125
NameANANOLIGNAN C
ChEMBL IDCHEMBL1782111
Molecular FormulaC23H28O8
Molecular Weight432.47
Molecular Weight (Monoisotopic)432.1784
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsAnanolignan C
SmilesCOc1cc2c(c(OC)c1OC)-c1c(cc3c(c1OC)OCO3)[C@H](O)[C@H](C)[C@H](C)[C@@H]2O
InchiInChI=1S/C23H28O8/c1-10-11(2)19(25)13-8-15-21(31-9-30-15)23(29-6)17(13)16-12(18(10)24)7-14(26-3)20(27-4)22(16)28-5/h7-8,10-11,18-19,24-25H,9H2,1-6H3/t10-,11+,18-,19+/m0/s1
Inchi KeyRGJPPASWKJBDTJ-XJSVZPCESA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities2.0
Np Likeness Score1.35
Records Key['3']
Records Name['Ananolignan C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure