Bioactive Compound Details

BioIDbio512
NameFERRUGININ C
ChEMBL IDCHEMBL468446
Molecular FormulaC35H44O4
Molecular Weight528.73
Molecular Weight (Monoisotopic)528.324
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsFerruginin C
SmilesCC(C)=CCC1=C(O)C(CC=C(C)C)(CC=C(C)C)c2cc3c(CC=C(C)C)c(C)cc(O)c3c(O)c2C1=O
InchiInChI=1S/C35H44O4/c1-20(2)10-12-25-24(9)18-29(36)30-27(25)19-28-31(33(30)38)32(37)26(13-11-21(3)4)34(39)35(28,16-14-22(5)6)17-15-23(7)8/h10-11,14-15,18-19,36,38-39H,12-13,16-17H2,1-9H3
Inchi KeySUULLHWCJDOMBX-UHFFFAOYSA-N
Molecular SpeciesACID
Targets3.0
Bioactivities3.0
Np Likeness Score1.93
Records Key['1, Ferruginin C']
Records Name['(3,8,9-Trihydroxy-6-methyl-2,4,4,5-tetrakis(3-methyl-2-butenyl)-1(4H)-anthracenone']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure