Bioactive Compound Details

BioIDbio1202
NameNone
ChEMBL IDCHEMBL463256
Molecular FormulaC25H28O6
Molecular Weight424.49
Molecular Weight (Monoisotopic)424.1886
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonyms(2R,3R)-Lespedezaflavanone C
SmilesCC(C)=CCc1cc([C@H]2Oc3c(CC=C(C)C)c(O)cc(O)c3C(=O)[C@@H]2O)ccc1O
InchiInChI=1S/C25H28O6/c1-13(2)5-7-15-11-16(8-10-18(15)26)24-23(30)22(29)21-20(28)12-19(27)17(25(21)31-24)9-6-14(3)4/h5-6,8,10-12,23-24,26-28,30H,7,9H2,1-4H3/t23-,24+/m0/s1
Inchi KeyWFHBGCVPESHDKZ-BJKOFHAPSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score2.29
Records Key['(2R,3R)-lespedezaflavanone C']
Records Name['(2R,3R)-lespedezaflavanone C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure