Bioactive Compound Details

BioIDbio745
NamePIPERKADSIN C
ChEMBL IDCHEMBL604682
Molecular FormulaC20H20O5
Molecular Weight340.38
Molecular Weight (Monoisotopic)340.1311
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsPiperkadsin C
SmilesC=CCC1=CC2=C(OC)[C@H](C1=O)[C@]2(C)[C@H](O)c1ccc2c(c1)OCO2
InchiInChI=1S/C20H20O5/c1-4-5-11-8-13-18(23-3)16(17(11)21)20(13,2)19(22)12-6-7-14-15(9-12)25-10-24-14/h4,6-9,16,19,22H,1,5,10H2,2-3H3/t16-,19+,20+/m0/s1
Inchi KeyNOXNHMNKQIHADP-PWIZWCRZSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities6.0
Np Likeness Score1.32
Records Key['1']
Records Name['piperkadsin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure