Bioactive Compound Details

BioIDbio334
NameOLIGANTHIN C
ChEMBL IDCHEMBL2013056
Molecular FormulaC33H40O7
Molecular Weight548.68
Molecular Weight (Monoisotopic)548.2774
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsOliganthin C
SmilesCC(C)=CCc1c(O)cc2oc3c(c(=O)c2c1O)C(CC=C(C)C)(CC=C(C)C)C(=O)C(O)(CC=C(C)C)C3=O
InchiInChI=1S/C33H40O7/c1-18(2)9-10-22-23(34)17-24-25(27(22)35)28(36)26-29(40-24)30(37)33(39,16-13-21(7)8)31(38)32(26,14-11-19(3)4)15-12-20(5)6/h9,11-13,17,34-35,39H,10,14-16H2,1-8H3
Inchi KeyYESGPFGMANPCDL-UHFFFAOYSA-N
Molecular SpeciesACID
Targets2.0
Bioactivities5.0
Np Likeness Score1.58
Records Key['3']
Records Name['Oliganthin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure