Bioactive Compound Details

BioIDbio957
NameLIGRAMINOL C
ChEMBL IDCHEMBL1928003
Molecular FormulaC23H28O6
Molecular Weight400.47
Molecular Weight (Monoisotopic)400.1886
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsLigraminol C
SmilesC/C=C\c1ccc(O[C@H](C)[C@H](OC(C)=O)c2ccc(OC)c(OC)c2)c(OC)c1
InchiInChI=1S/C23H28O6/c1-7-8-17-9-11-20(21(13-17)26-5)28-15(2)23(29-16(3)24)18-10-12-19(25-4)22(14-18)27-6/h7-15,23H,1-6H3/b8-7-/t15-,23+/m1/s1
Inchi KeyPYVVKTYHVHGNMI-ZJTDORCHSA-N
Molecular SpeciesNEUTRAL
Targets5.0
Bioactivities6.0
Np Likeness Score0.88
Records Key['3']
Records Name['ligraminol C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure