Bioactive Compound Details

BioIDbio929
NameILICICOLIN C
ChEMBL IDCHEMBL560024
Molecular FormulaC23H31ClO4
Molecular Weight406.95
Molecular Weight (Monoisotopic)406.1911
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsIlicicolin C
SmilesC/C(=C\Cc1c(O)c(Cl)c(C)c(C=O)c1O)CC[C@@]1(C)[C@H](C)CCC(=O)[C@@H]1C
InchiInChI=1S/C23H31ClO4/c1-13(10-11-23(5)14(2)7-9-19(26)16(23)4)6-8-17-21(27)18(12-25)15(3)20(24)22(17)28/h6,12,14,16,27-28H,7-11H2,1-5H3/b13-6+/t14-,16+,23+/m1/s1
Inchi KeyIJEHYEVNWOYGMS-WGUBEYSISA-N
Molecular SpeciesACID
Targets4.0
Bioactivities4.0
Np Likeness Score2.39
Records Key['12', '11']
Records Name['Ilicicolin C', 'Ilicicolin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure